Model |
Model Title |
Test Result |
EDIP_BOP_Bazant_Kaxiras_Si__MO_958932894036_001 |
Original EDIP potential for elemental silicon. |
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Four_Body_Mistriotis_Flytzanis_Farantos_Si__MO_080526771943_000 |
A four-body Mistriotis-Flytzanis-Farantos Model for Silicon |
view |
LennardJones612_UniversalShifted__MO_959249795837_002 |
Efficient "universal" shifted Lennard-Jones model for all KIM API supported species |
view |
Tersoff_LAMMPS_Erhart_Albe_CSi__MO_903987585848_001 |
Tersoff-style three-body potential for SiC by Erhart/Albe |
view |
Tersoff_LAMMPS_Erhart_Albe_CSi__MO_903987585848_002 |
Tersoff-style three-body potential for SiC by Erhart/Albe |
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Tersoff_LAMMPS_Erhart_Albe_SiII_CSi__MO_408791041969_000 |
Tersoff-style three-body potential for SiC by Erhart/Albe, parameter set Si II |
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Tersoff_LAMMPS_Erhart_Albe_SiII_CSi__MO_408791041969_001 |
Tersoff-style three-body potential for SiC by Erhart/Albe, parameter set Si II |
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Tersoff_LAMMPS_Tersoff_PRB37_1988_Si__MO_245095684871_000 |
Tersoff's silicon potential (PRB 37, 1988) |
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Tersoff_LAMMPS_Tersoff_PRB37_1988_Si__MO_245095684871_001 |
Tersoff's silicon potential (PRB 37, 1988) |
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Tersoff_LAMMPS_Tersoff_PRB38_1988_Si__MO_186459956893_000 |
Tersoff's silicon potential (PRB 38, 1988) |
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Tersoff_LAMMPS_Tersoff_PRB38_1988_Si__MO_186459956893_001 |
Tersoff's silicon potential (PRB 38, 1988) |
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Tersoff_LAMMPS_Tersoff_PRB39_1989_CSi__MO_171585019474_000 |
Tersoff's silicon carbide potential (PRB 39, 1989) |
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Tersoff_LAMMPS_Tersoff_PRB39_1989_CSi__MO_171585019474_001 |
Tersoff's silicon carbide potential (PRB 39, 1989) |
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Tersoff_LAMMPS_Tersoff_PRB39_1989_GeSi__MO_350526375143_000 |
Tersoff's silicon germanium potential (PRB 39, 1989) |
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Tersoff_LAMMPS_Tersoff_PRB39_1989_GeSi__MO_350526375143_001 |
Tersoff's silicon germanium potential (PRB 39, 1989) |
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Three_Body_Stillinger_Weber_Balamane_Hauch_Brittle_Si__MO_381114941873_000 |
Three Body Stillinger Weber Combined Balamane and Hauch Brittle Silicon |
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Three_Body_Stillinger_Weber_Balamane_Hauch_Brittle_Si__MO_381114941873_001 |
Three Body Stillinger Weber Combined Balamane and Hauch Brittle Silicon |
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Three_Body_Stillinger_Weber_Balamane_Si__MO_113686039439_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Balamane et al |
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Three_Body_Stillinger_Weber_Balamane_Si__MO_113686039439_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Balamane et al |
view |
Three_Body_Stillinger_Weber_Hauch_Brittle_Si__MO_119167353542_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Hauch et al |
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Three_Body_Stillinger_Weber_Hauch_Brittle_Si__MO_119167353542_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Hauch et al |
view |
Three_Body_Stillinger_Weber_Si__MO_405512056662_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon |
view |
Three_Body_Stillinger_Weber_Si__MO_405512056662_004 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model1_Si__MO_800412945727_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model1_Si__MO_800412945727_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model2_Si__MO_475612090600_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model2_Si__MO_475612090600_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Model |
Model Title |
Test Result |
EDIP_JustoBazantKaxiras_1998_Si__MO_958932894036_002 |
EDIP model for Si developed by Justo et al. (1998) v002 |
view |
EDIP_LAMMPS_JiangMorganSzlufarska_2012_SiC__MO_667792548433_000 |
EDIP model for SiC developed by Jiang, Morgan, and Szlufarska (2012) v000 |
view |
EDIP_LAMMPS_JustoBazantKaxiras_1998_Si__MO_315965276297_000 |
EDIP model for Si developed by Justo et al. (1998) v000 |
view |
EDIP_LAMMPS_LucasBertolusPizzagalli_2009_SiC__MO_634310164305_000 |
EDIP potential for Si-C developed by Lucas, Bertolus, and Pizzagalli (2009) v000 |
view |
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003 |
Efficient 'universal' shifted Lennard-Jones model for all KIM API supported species developed by Elliott and Akerson (2015) v003 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_000 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v000 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_001 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v001 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_002 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v002 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_000 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v000 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_001 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v001 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_002 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v002 |
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MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_000 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v000 |
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MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_001 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v001 |
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MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_002 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v002 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_000 |
MEAM potential for Si developed by Huang et al. (2018) v000 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_001 |
MEAM potential for Si developed by Huang et al. (2018) v001 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_002 |
MEAM potential for Si developed by Huang et al. (2018) v002 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_000 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v000 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_001 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v001 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_002 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v002 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_000 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v000 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_001 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v001 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_002 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v002 |
view |
MEAM_LAMMPS_Lee_2007_Si__MO_774917820956_000 |
MEAM Potential for Si developed by Lee (2007) v000 |
view |
MEAM_LAMMPS_Lee_2007_Si__MO_774917820956_001 |
MEAM Potential for Si developed by Lee (2007) v001 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_000 |
MEAM potential for Si system developed by Lenosky et al. (2000) v000 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_001 |
MEAM potential for Si system developed by Lenosky et al. (2000) v001 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_002 |
MEAM potential for Si system developed by Lenosky et al. (2000) v002 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_000 |
MEAM potential for Si-C developed by Wagner (2007) v000 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_001 |
MEAM potential for Si-C developed by Wagner (2007) v001 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_002 |
MEAM potential for Si-C developed by Wagner (2007) v002 |
view |
MFF_MistriotisFlytzanisFarantos_1989_Si__MO_080526771943_001 |
MFF potential for Si developed by Mistriotis, Flytzanis and Farantos (1989) v001 |
view |
Sim_LAMMPS_ADP_StarikovGordeevLysogorskiy_2020_SiAuAl__SM_113843830602_000 |
LAMMPS ADP potential for the Si-Au-Al system developed by Starikov et al. (2020) v000 |
view |
Sim_LAMMPS_ADP_StarikovLopanitsynaSmirnova_2018_SiAu__SM_985135773293_000 |
LAMMPS ADP potential for the Si-Au system developed by Starikov et al. (2018) v000 |
view |
Sim_LAMMPS_Buckingham_CarreHorbachIspas_2008_SiO__SM_886641404623_000 |
LAMMPS Buckingham potential for SiO2 developed by Carré et al. (2008) v000 |
view |
Sim_LAMMPS_EDIP_LucasBertolusPizzagalli_2009_SiC__SM_435704953434_000 |
LAMMPS EDIP potential for Si-C developed by Lucas, Bertolus, and Pizzagalli (2009) v000 |
view |
Sim_LAMMPS_GW_GaoWeber_2002_SiC__SM_606253546840_000 |
LAMMPS Gao-Weber potential for Si-C developed by Gao and Weber (2002) v000 |
view |
Sim_LAMMPS_GWZBL_Samolyuk_2016_SiC__SM_720598599889_000 |
LAMMPS Gao-Weber potential combined with a modified repulsive ZBL core function for the Si-C system developed by German Samolyuk (2016) v000 |
view |
Sim_LAMMPS_MEAM_CuiGaoCui_2012_LiSi__SM_562938628131_000 |
LAMMPS MEAM potential for Li-Si alloys developed by Cui et al. (2012) v000 |
view |
Sim_LAMMPS_MEAM_DuLenoskyHennig_2011_Si__SM_662785656123_000 |
LAMMPS Spline-based MEAM potential for Si system developed by Du et al. (2011) v000 |
view |
Sim_LAMMPS_MEAM_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__SM_656517352485_000 |
LAMMPS MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v000 |
view |
Sim_LAMMPS_MEAM_LenoskySadighAlonso_2000_Si__SM_622320990752_000 |
LAMMPS MEAM potential for Si system developed by Lenosky et al. (2000) v000 |
view |
Sim_LAMMPS_MEAM_Wagner_2007_SiC__SM_264944083668_000 |
LAMMPS MEAM potential for Si-C developed by Wagner (2007) v000 |
view |
Sim_LAMMPS_ModifiedTersoff_KumagaiIzumiHara_2007_Si__SM_773333226968_000 |
LAMMPS Modified Tersoff potential for Si by Kumagai et al. (2007) v000 |
view |
Sim_LAMMPS_ModifiedTersoff_PurjaPunMishin_2017_Si__SM_184524061456_000 |
LAMMPS Modified Tersoff potential for Si developed by Purja Pun and Mishin (2017) v000 |
view |
Sim_LAMMPS_ReaxFF_BrugnoliMiyataniAkaji_SiCeNaClHO_2023__SM_282799919035_000 |
LAMMPS ReaxFF potential for Ceria/Silica/Water/NaCl developed by Brugnoli et al. (2023) v000 |
view |
Sim_LAMMPS_ReaxFF_ManzanoMoeiniMarinelli_2012_CaSiOH__SM_714124634215_000 |
LAMMPS ReaxFF potential for Ca-Si-O-H systems developed by Manzano et al. (2012) v000 |
view |
Sim_LAMMPS_TersoffZBL_DevanathanDiazdelaRubiaWeber_1998_SiC__SM_578912636995_000 |
LAMMPS Tersoff-ZBL potential for Si-C developed by Devanathan, Diaz de la Rubia, and Weber (1998) v000 |
view |
Sim_LAMMPS_Vashishta_BroughtonMeliVashishta_1997_SiO__SM_422553794879_000 |
LAMMPS Vashishta potential for the Si-O system developed by Broughton et al. (1997) v000 |
view |
Sim_LAMMPS_Vashishta_NakanoKaliaVashishta_1994_SiO__SM_503555646986_000 |
LAMMPS Vashishta potential for the Si-O system developed by Nakano et al. (1994) v000 |
view |
Sim_LAMMPS_Vashishta_VashishtaKaliaNakano_2007_SiC__SM_196548226654_000 |
LAMMPS Vashishta potential for the Si-C system developed by Vashishta et al. (2007) v000 |
view |
Sim_LAMMPS_Vashishta_VashishtaKaliaRino_1990_SiO__SM_887826436433_000 |
LAMMPS Vashishta potential for the Si-O system developed by Vashishta et al. (1990) v000 |
view |
SNAP_ZuoChenLi_2019_Si__MO_869330304805_000 |
A spectral neighbor analysis potential for Si developed by Yunxing Zuo v000 |
view |
SNAP_ZuoChenLi_2019quadratic_Si__MO_721469752060_000 |
A quadratic spectral neighbor analysis potential for Si developed by Yunxing Zuo v000 |
view |
SW_BalamaneHaliciogluTiller_1992_Si__MO_113686039439_004 |
Stillinger-Weber potential for Si developed by Balamane, Halicioglu and Tiller (1992) v004 |
view |
SW_BalamaneHaliciogluTiller_1992_Si__MO_113686039439_005 |
Stillinger-Weber potential for Si developed by Balamane, Halicioglu and Tiller (1992) v005 |
view |
SW_BalamaneHauchShi_2017Brittle_Si__MO_381114941873_002 |
Stillinger-Weber potential for brittle Si combining the modifications of Balamane et al. (1992) and Hauch et al. (1999) v002 |
view |
SW_BalamaneHauchShi_2017Brittle_Si__MO_381114941873_003 |
Stillinger-Weber potential for brittle Si combining the modifications of Balamane et al. (1992) and Hauch et al. (1999) v003 |
view |
SW_HauchHollandMarder_1999Brittle_Si__MO_119167353542_004 |
Stillinger-Weber potential for brittle Si due to Hauch et al. (1999) v004 |
view |
SW_HauchHollandMarder_1999Brittle_Si__MO_119167353542_005 |
Stillinger-Weber potential for brittle Si due to Hauch et al. (1999) v005 |
view |
SW_LeeHwang_2012GGA_Si__MO_040570764911_000 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); GGA parameterization v000 |
view |
SW_LeeHwang_2012GGA_Si__MO_040570764911_001 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); GGA parameterization v001 |
view |
SW_LeeHwang_2012LDA_Si__MO_517338295712_000 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); LDA parameterization v000 |
view |
SW_LeeHwang_2012LDA_Si__MO_517338295712_001 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); LDA parameterization v001 |
view |
SW_StillingerWeber_1985_Si__MO_405512056662_005 |
Stillinger-Weber potential for Si due to Stillinger and Weber (1985) v005 |
view |
SW_StillingerWeber_1985_Si__MO_405512056662_006 |
Stillinger-Weber potential for Si due to Stillinger and Weber (1985) v006 |
view |
SW_ZhangXieHu_2014OptimizedSW1_Si__MO_800412945727_004 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW1' v004 |
view |
SW_ZhangXieHu_2014OptimizedSW1_Si__MO_800412945727_005 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW1' v005 |
view |
SW_ZhangXieHu_2014OptimizedSW2_Si__MO_475612090600_004 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW2' v004 |
view |
SW_ZhangXieHu_2014OptimizedSW2_Si__MO_475612090600_005 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW2' v005 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_003 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v003 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_004 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v004 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_005 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v005 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_002 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v002 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_003 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v003 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_004 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v004 |
view |
Tersoff_LAMMPS_MunetohMotookaMoriguchi_2007_SiO__MO_501246546792_000 |
Tersoff-style three-body potential for SiO developed by Munetoh et al. (2007) v000 |
view |
Tersoff_LAMMPS_PlummerTucker_2019_TiSiC__MO_751442731010_000 |
Tersoff-style three-body potential for TiSiC developed by Plummer and Tucker (2019) v000 |
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Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_002 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v002 |
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Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_003 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v003 |
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Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_004 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v004 |
view |
Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_002 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v002 |
view |
Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_003 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v003 |
view |
Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_004 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v004 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiC__MO_171585019474_002 |
Tersoff-style three-body potential for SiC developed by Tersoff (1989) v002 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiC__MO_171585019474_003 |
Tersoff-style three-body potential for SiC developed by Tersoff (1989) v003 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_002 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v002 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_003 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v003 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_004 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v004 |
view |
Tersoff_LAMMPS_Tersoff_1990_SiC__MO_444207127575_000 |
Tersoff-style three-body potential for SiC developed by Tersoff (1990) v000 |
view |
Tersoff_LAMMPS_Tersoff_1994_SiC__MO_794973922560_000 |
Tersoff-style three-body potential for SiC developed by Tersoff (1994) v000 |
view |
ThreeBodyBondOrder_KDS_KhorDasSarma_1988_Si__MO_722489435928_000 |
Three-body cluster potential for Si by Khor and Das Sarma (1988) v000 |
view |
ThreeBodyBondOrder_PPM_PurjaPunMishin_2017_Si__MO_566683736730_000 |
Three-body bond-order potential for Si by Purja Pun and Mishin (2017) v000 |
view |
ThreeBodyBondOrder_WR_WangRockett_1991_Si__MO_081872846741_000 |
Three-body bond-order potential for Si by Wang and Rockett (1991) v000 |
view |
ThreeBodyCluster_BH_BiswasHamann_1987_Si__MO_019616213550_000 |
Three-body cluster potential for Si by Biswas and Hamann (1987) v000 |
view |
ThreeBodyCluster_Gong_Gong_1993_Si__MO_407755720412_000 |
Three-body cluster potential for Si by Gong (1993) v000 |
view |
ThreeBodyCluster_KP_KaxirasPandey_1988_Si__MO_072486242437_000 |
Three-body cluster potential for Si by Kaxiras and Pandey (1988) v000 |
view |
ThreeBodyCluster_SRS_StephensonRadnySmith_1996_Si__MO_604248666067_000 |
Three-body cluster potential for Si by Stephenson, Radny and Smith (1996) v000 |
view |
TorchML_NequIP_GuptaTadmorMartiniani_2024_Si__MO_196181738937_000 |
Parallel NequIP Equivariant GNN for Si developed by Gupta et al. (2024) v000 |
view |
Model |
Model Title |
Test Result |
EDIP_BOP_Bazant_Kaxiras_Si__MO_958932894036_001 |
Original EDIP potential for elemental silicon. |
view |
Four_Body_Mistriotis_Flytzanis_Farantos_Si__MO_080526771943_000 |
A four-body Mistriotis-Flytzanis-Farantos Model for Silicon |
view |
LennardJones612_UniversalShifted__MO_959249795837_002 |
Efficient "universal" shifted Lennard-Jones model for all KIM API supported species |
view |
Tersoff_LAMMPS_Erhart_Albe_CSi__MO_903987585848_001 |
Tersoff-style three-body potential for SiC by Erhart/Albe |
view |
Tersoff_LAMMPS_Erhart_Albe_CSi__MO_903987585848_002 |
Tersoff-style three-body potential for SiC by Erhart/Albe |
view |
Tersoff_LAMMPS_Erhart_Albe_SiII_CSi__MO_408791041969_000 |
Tersoff-style three-body potential for SiC by Erhart/Albe, parameter set Si II |
view |
Tersoff_LAMMPS_Erhart_Albe_SiII_CSi__MO_408791041969_001 |
Tersoff-style three-body potential for SiC by Erhart/Albe, parameter set Si II |
view |
Tersoff_LAMMPS_Tersoff_PRB37_1988_Si__MO_245095684871_000 |
Tersoff's silicon potential (PRB 37, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB37_1988_Si__MO_245095684871_001 |
Tersoff's silicon potential (PRB 37, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB38_1988_Si__MO_186459956893_000 |
Tersoff's silicon potential (PRB 38, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB38_1988_Si__MO_186459956893_001 |
Tersoff's silicon potential (PRB 38, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_CSi__MO_171585019474_000 |
Tersoff's silicon carbide potential (PRB 39, 1989) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_CSi__MO_171585019474_001 |
Tersoff's silicon carbide potential (PRB 39, 1989) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_GeSi__MO_350526375143_000 |
Tersoff's silicon germanium potential (PRB 39, 1989) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_GeSi__MO_350526375143_001 |
Tersoff's silicon germanium potential (PRB 39, 1989) |
view |
Three_Body_Stillinger_Weber_Balamane_Hauch_Brittle_Si__MO_381114941873_000 |
Three Body Stillinger Weber Combined Balamane and Hauch Brittle Silicon |
view |
Three_Body_Stillinger_Weber_Balamane_Hauch_Brittle_Si__MO_381114941873_001 |
Three Body Stillinger Weber Combined Balamane and Hauch Brittle Silicon |
view |
Three_Body_Stillinger_Weber_Balamane_Si__MO_113686039439_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Balamane et al |
view |
Three_Body_Stillinger_Weber_Balamane_Si__MO_113686039439_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Balamane et al |
view |
Three_Body_Stillinger_Weber_Hauch_Brittle_Si__MO_119167353542_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Hauch et al |
view |
Three_Body_Stillinger_Weber_Hauch_Brittle_Si__MO_119167353542_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Hauch et al |
view |
Three_Body_Stillinger_Weber_Si__MO_405512056662_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon |
view |
Three_Body_Stillinger_Weber_Si__MO_405512056662_004 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model1_Si__MO_800412945727_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model1_Si__MO_800412945727_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model2_Si__MO_475612090600_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model2_Si__MO_475612090600_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Model |
Model Title |
Test Result |
EDIP_JustoBazantKaxiras_1998_Si__MO_958932894036_002 |
EDIP model for Si developed by Justo et al. (1998) v002 |
view |
EDIP_LAMMPS_JiangMorganSzlufarska_2012_SiC__MO_667792548433_000 |
EDIP model for SiC developed by Jiang, Morgan, and Szlufarska (2012) v000 |
view |
EDIP_LAMMPS_JustoBazantKaxiras_1998_Si__MO_315965276297_000 |
EDIP model for Si developed by Justo et al. (1998) v000 |
view |
EDIP_LAMMPS_LucasBertolusPizzagalli_2009_SiC__MO_634310164305_000 |
EDIP potential for Si-C developed by Lucas, Bertolus, and Pizzagalli (2009) v000 |
view |
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003 |
Efficient 'universal' shifted Lennard-Jones model for all KIM API supported species developed by Elliott and Akerson (2015) v003 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_000 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v000 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_001 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v001 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_002 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v002 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_000 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v000 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_001 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v001 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_002 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v002 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_000 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v000 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_001 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v001 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_002 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v002 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_000 |
MEAM potential for Si developed by Huang et al. (2018) v000 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_001 |
MEAM potential for Si developed by Huang et al. (2018) v001 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_002 |
MEAM potential for Si developed by Huang et al. (2018) v002 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_000 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v000 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_001 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v001 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_002 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v002 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_000 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v000 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_001 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v001 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_002 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v002 |
view |
MEAM_LAMMPS_Lee_2007_Si__MO_774917820956_000 |
MEAM Potential for Si developed by Lee (2007) v000 |
view |
MEAM_LAMMPS_Lee_2007_Si__MO_774917820956_001 |
MEAM Potential for Si developed by Lee (2007) v001 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_000 |
MEAM potential for Si system developed by Lenosky et al. (2000) v000 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_001 |
MEAM potential for Si system developed by Lenosky et al. (2000) v001 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_002 |
MEAM potential for Si system developed by Lenosky et al. (2000) v002 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_000 |
MEAM potential for Si-C developed by Wagner (2007) v000 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_001 |
MEAM potential for Si-C developed by Wagner (2007) v001 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_002 |
MEAM potential for Si-C developed by Wagner (2007) v002 |
view |
MFF_MistriotisFlytzanisFarantos_1989_Si__MO_080526771943_001 |
MFF potential for Si developed by Mistriotis, Flytzanis and Farantos (1989) v001 |
view |
Sim_LAMMPS_ADP_StarikovGordeevLysogorskiy_2020_SiAuAl__SM_113843830602_000 |
LAMMPS ADP potential for the Si-Au-Al system developed by Starikov et al. (2020) v000 |
view |
Sim_LAMMPS_ADP_StarikovLopanitsynaSmirnova_2018_SiAu__SM_985135773293_000 |
LAMMPS ADP potential for the Si-Au system developed by Starikov et al. (2018) v000 |
view |
Sim_LAMMPS_EDIP_LucasBertolusPizzagalli_2009_SiC__SM_435704953434_000 |
LAMMPS EDIP potential for Si-C developed by Lucas, Bertolus, and Pizzagalli (2009) v000 |
view |
Sim_LAMMPS_GW_GaoWeber_2002_SiC__SM_606253546840_000 |
LAMMPS Gao-Weber potential for Si-C developed by Gao and Weber (2002) v000 |
view |
Sim_LAMMPS_GWZBL_Samolyuk_2016_SiC__SM_720598599889_000 |
LAMMPS Gao-Weber potential combined with a modified repulsive ZBL core function for the Si-C system developed by German Samolyuk (2016) v000 |
view |
Sim_LAMMPS_MEAM_CuiGaoCui_2012_LiSi__SM_562938628131_000 |
LAMMPS MEAM potential for Li-Si alloys developed by Cui et al. (2012) v000 |
view |
Sim_LAMMPS_MEAM_DuLenoskyHennig_2011_Si__SM_662785656123_000 |
LAMMPS Spline-based MEAM potential for Si system developed by Du et al. (2011) v000 |
view |
Sim_LAMMPS_MEAM_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__SM_656517352485_000 |
LAMMPS MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v000 |
view |
Sim_LAMMPS_MEAM_LenoskySadighAlonso_2000_Si__SM_622320990752_000 |
LAMMPS MEAM potential for Si system developed by Lenosky et al. (2000) v000 |
view |
Sim_LAMMPS_MEAM_Wagner_2007_SiC__SM_264944083668_000 |
LAMMPS MEAM potential for Si-C developed by Wagner (2007) v000 |
view |
Sim_LAMMPS_ModifiedTersoff_KumagaiIzumiHara_2007_Si__SM_773333226968_000 |
LAMMPS Modified Tersoff potential for Si by Kumagai et al. (2007) v000 |
view |
Sim_LAMMPS_ModifiedTersoff_PurjaPunMishin_2017_Si__SM_184524061456_000 |
LAMMPS Modified Tersoff potential for Si developed by Purja Pun and Mishin (2017) v000 |
view |
Sim_LAMMPS_ReaxFF_BrugnoliMiyataniAkaji_SiCeNaClHO_2023__SM_282799919035_000 |
LAMMPS ReaxFF potential for Ceria/Silica/Water/NaCl developed by Brugnoli et al. (2023) v000 |
view |
Sim_LAMMPS_ReaxFF_ManzanoMoeiniMarinelli_2012_CaSiOH__SM_714124634215_000 |
LAMMPS ReaxFF potential for Ca-Si-O-H systems developed by Manzano et al. (2012) v000 |
view |
Sim_LAMMPS_TersoffZBL_DevanathanDiazdelaRubiaWeber_1998_SiC__SM_578912636995_000 |
LAMMPS Tersoff-ZBL potential for Si-C developed by Devanathan, Diaz de la Rubia, and Weber (1998) v000 |
view |
Sim_LAMMPS_Vashishta_BroughtonMeliVashishta_1997_SiO__SM_422553794879_000 |
LAMMPS Vashishta potential for the Si-O system developed by Broughton et al. (1997) v000 |
view |
Sim_LAMMPS_Vashishta_NakanoKaliaVashishta_1994_SiO__SM_503555646986_000 |
LAMMPS Vashishta potential for the Si-O system developed by Nakano et al. (1994) v000 |
view |
Sim_LAMMPS_Vashishta_VashishtaKaliaNakano_2007_SiC__SM_196548226654_000 |
LAMMPS Vashishta potential for the Si-C system developed by Vashishta et al. (2007) v000 |
view |
Sim_LAMMPS_Vashishta_VashishtaKaliaRino_1990_SiO__SM_887826436433_000 |
LAMMPS Vashishta potential for the Si-O system developed by Vashishta et al. (1990) v000 |
view |
SNAP_ZuoChenLi_2019_Si__MO_869330304805_000 |
A spectral neighbor analysis potential for Si developed by Yunxing Zuo v000 |
view |
SNAP_ZuoChenLi_2019quadratic_Si__MO_721469752060_000 |
A quadratic spectral neighbor analysis potential for Si developed by Yunxing Zuo v000 |
view |
SW_BalamaneHaliciogluTiller_1992_Si__MO_113686039439_004 |
Stillinger-Weber potential for Si developed by Balamane, Halicioglu and Tiller (1992) v004 |
view |
SW_BalamaneHaliciogluTiller_1992_Si__MO_113686039439_005 |
Stillinger-Weber potential for Si developed by Balamane, Halicioglu and Tiller (1992) v005 |
view |
SW_BalamaneHauchShi_2017Brittle_Si__MO_381114941873_002 |
Stillinger-Weber potential for brittle Si combining the modifications of Balamane et al. (1992) and Hauch et al. (1999) v002 |
view |
SW_BalamaneHauchShi_2017Brittle_Si__MO_381114941873_003 |
Stillinger-Weber potential for brittle Si combining the modifications of Balamane et al. (1992) and Hauch et al. (1999) v003 |
view |
SW_HauchHollandMarder_1999Brittle_Si__MO_119167353542_004 |
Stillinger-Weber potential for brittle Si due to Hauch et al. (1999) v004 |
view |
SW_HauchHollandMarder_1999Brittle_Si__MO_119167353542_005 |
Stillinger-Weber potential for brittle Si due to Hauch et al. (1999) v005 |
view |
SW_LeeHwang_2012GGA_Si__MO_040570764911_000 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); GGA parameterization v000 |
view |
SW_LeeHwang_2012GGA_Si__MO_040570764911_001 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); GGA parameterization v001 |
view |
SW_LeeHwang_2012LDA_Si__MO_517338295712_000 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); LDA parameterization v000 |
view |
SW_LeeHwang_2012LDA_Si__MO_517338295712_001 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); LDA parameterization v001 |
view |
SW_StillingerWeber_1985_Si__MO_405512056662_005 |
Stillinger-Weber potential for Si due to Stillinger and Weber (1985) v005 |
view |
SW_StillingerWeber_1985_Si__MO_405512056662_006 |
Stillinger-Weber potential for Si due to Stillinger and Weber (1985) v006 |
view |
SW_ZhangXieHu_2014OptimizedSW1_Si__MO_800412945727_004 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW1' v004 |
view |
SW_ZhangXieHu_2014OptimizedSW1_Si__MO_800412945727_005 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW1' v005 |
view |
SW_ZhangXieHu_2014OptimizedSW2_Si__MO_475612090600_004 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW2' v004 |
view |
SW_ZhangXieHu_2014OptimizedSW2_Si__MO_475612090600_005 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW2' v005 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_003 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v003 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_004 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v004 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_005 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v005 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_002 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v002 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_003 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v003 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_004 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v004 |
view |
Tersoff_LAMMPS_MunetohMotookaMoriguchi_2007_SiO__MO_501246546792_000 |
Tersoff-style three-body potential for SiO developed by Munetoh et al. (2007) v000 |
view |
Tersoff_LAMMPS_PlummerTucker_2019_TiSiC__MO_751442731010_000 |
Tersoff-style three-body potential for TiSiC developed by Plummer and Tucker (2019) v000 |
view |
Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_002 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v002 |
view |
Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_003 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v003 |
view |
Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_004 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v004 |
view |
Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_002 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v002 |
view |
Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_003 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v003 |
view |
Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_004 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v004 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiC__MO_171585019474_002 |
Tersoff-style three-body potential for SiC developed by Tersoff (1989) v002 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiC__MO_171585019474_003 |
Tersoff-style three-body potential for SiC developed by Tersoff (1989) v003 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_002 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v002 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_003 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v003 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_004 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v004 |
view |
Tersoff_LAMMPS_Tersoff_1990_SiC__MO_444207127575_000 |
Tersoff-style three-body potential for SiC developed by Tersoff (1990) v000 |
view |
Tersoff_LAMMPS_Tersoff_1994_SiC__MO_794973922560_000 |
Tersoff-style three-body potential for SiC developed by Tersoff (1994) v000 |
view |
ThreeBodyBondOrder_KDS_KhorDasSarma_1988_Si__MO_722489435928_000 |
Three-body cluster potential for Si by Khor and Das Sarma (1988) v000 |
view |
ThreeBodyBondOrder_PPM_PurjaPunMishin_2017_Si__MO_566683736730_000 |
Three-body bond-order potential for Si by Purja Pun and Mishin (2017) v000 |
view |
ThreeBodyBondOrder_WR_WangRockett_1991_Si__MO_081872846741_000 |
Three-body bond-order potential for Si by Wang and Rockett (1991) v000 |
view |
ThreeBodyCluster_BH_BiswasHamann_1987_Si__MO_019616213550_000 |
Three-body cluster potential for Si by Biswas and Hamann (1987) v000 |
view |
ThreeBodyCluster_Gong_Gong_1993_Si__MO_407755720412_000 |
Three-body cluster potential for Si by Gong (1993) v000 |
view |
ThreeBodyCluster_KP_KaxirasPandey_1988_Si__MO_072486242437_000 |
Three-body cluster potential for Si by Kaxiras and Pandey (1988) v000 |
view |
ThreeBodyCluster_SRS_StephensonRadnySmith_1996_Si__MO_604248666067_000 |
Three-body cluster potential for Si by Stephenson, Radny and Smith (1996) v000 |
view |
TorchML_MACE_GuptaTadmorMartiniani_2024_Si__MO_781946209112_000 |
Parallel MACE Equivariant GNN for Si developed by Gupta et al. (2024) v000 |
view |
TorchML_NequIP_GuptaTadmorMartiniani_2024_Si__MO_196181738937_000 |
Parallel NequIP Equivariant GNN for Si developed by Gupta et al. (2024) v000 |
view |
Model |
Model Title |
Test Result |
EDIP_BOP_Bazant_Kaxiras_Si__MO_958932894036_001 |
Original EDIP potential for elemental silicon. |
view |
Four_Body_Mistriotis_Flytzanis_Farantos_Si__MO_080526771943_000 |
A four-body Mistriotis-Flytzanis-Farantos Model for Silicon |
view |
LennardJones612_UniversalShifted__MO_959249795837_002 |
Efficient "universal" shifted Lennard-Jones model for all KIM API supported species |
view |
Tersoff_LAMMPS_Erhart_Albe_CSi__MO_903987585848_001 |
Tersoff-style three-body potential for SiC by Erhart/Albe |
view |
Tersoff_LAMMPS_Erhart_Albe_CSi__MO_903987585848_002 |
Tersoff-style three-body potential for SiC by Erhart/Albe |
view |
Tersoff_LAMMPS_Erhart_Albe_SiII_CSi__MO_408791041969_000 |
Tersoff-style three-body potential for SiC by Erhart/Albe, parameter set Si II |
view |
Tersoff_LAMMPS_Erhart_Albe_SiII_CSi__MO_408791041969_001 |
Tersoff-style three-body potential for SiC by Erhart/Albe, parameter set Si II |
view |
Tersoff_LAMMPS_Tersoff_PRB37_1988_Si__MO_245095684871_000 |
Tersoff's silicon potential (PRB 37, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB37_1988_Si__MO_245095684871_001 |
Tersoff's silicon potential (PRB 37, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB38_1988_Si__MO_186459956893_000 |
Tersoff's silicon potential (PRB 38, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB38_1988_Si__MO_186459956893_001 |
Tersoff's silicon potential (PRB 38, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_CSi__MO_171585019474_000 |
Tersoff's silicon carbide potential (PRB 39, 1989) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_CSi__MO_171585019474_001 |
Tersoff's silicon carbide potential (PRB 39, 1989) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_GeSi__MO_350526375143_000 |
Tersoff's silicon germanium potential (PRB 39, 1989) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_GeSi__MO_350526375143_001 |
Tersoff's silicon germanium potential (PRB 39, 1989) |
view |
Three_Body_Stillinger_Weber_Balamane_Hauch_Brittle_Si__MO_381114941873_000 |
Three Body Stillinger Weber Combined Balamane and Hauch Brittle Silicon |
view |
Three_Body_Stillinger_Weber_Balamane_Hauch_Brittle_Si__MO_381114941873_001 |
Three Body Stillinger Weber Combined Balamane and Hauch Brittle Silicon |
view |
Three_Body_Stillinger_Weber_Balamane_Si__MO_113686039439_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Balamane et al |
view |
Three_Body_Stillinger_Weber_Balamane_Si__MO_113686039439_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Balamane et al |
view |
Three_Body_Stillinger_Weber_Hauch_Brittle_Si__MO_119167353542_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Hauch et al |
view |
Three_Body_Stillinger_Weber_Hauch_Brittle_Si__MO_119167353542_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Hauch et al |
view |
Three_Body_Stillinger_Weber_Si__MO_405512056662_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon |
view |
Three_Body_Stillinger_Weber_Si__MO_405512056662_004 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model1_Si__MO_800412945727_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model1_Si__MO_800412945727_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model2_Si__MO_475612090600_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model2_Si__MO_475612090600_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Model |
Model Title |
Test Result |
EDIP_JustoBazantKaxiras_1998_Si__MO_958932894036_002 |
EDIP model for Si developed by Justo et al. (1998) v002 |
view |
EDIP_LAMMPS_JiangMorganSzlufarska_2012_SiC__MO_667792548433_000 |
EDIP model for SiC developed by Jiang, Morgan, and Szlufarska (2012) v000 |
view |
EDIP_LAMMPS_JustoBazantKaxiras_1998_Si__MO_315965276297_000 |
EDIP model for Si developed by Justo et al. (1998) v000 |
view |
EDIP_LAMMPS_LucasBertolusPizzagalli_2009_SiC__MO_634310164305_000 |
EDIP potential for Si-C developed by Lucas, Bertolus, and Pizzagalli (2009) v000 |
view |
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003 |
Efficient 'universal' shifted Lennard-Jones model for all KIM API supported species developed by Elliott and Akerson (2015) v003 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_000 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v000 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_001 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v001 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_002 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v002 |
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MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_000 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v000 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_001 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v001 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_002 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v002 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_000 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v000 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_001 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v001 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_002 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v002 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_000 |
MEAM potential for Si developed by Huang et al. (2018) v000 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_001 |
MEAM potential for Si developed by Huang et al. (2018) v001 |
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MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_002 |
MEAM potential for Si developed by Huang et al. (2018) v002 |
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MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_000 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v000 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_001 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v001 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_002 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v002 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_000 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v000 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_001 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v001 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_002 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v002 |
view |
MEAM_LAMMPS_Lee_2007_Si__MO_774917820956_000 |
MEAM Potential for Si developed by Lee (2007) v000 |
view |
MEAM_LAMMPS_Lee_2007_Si__MO_774917820956_001 |
MEAM Potential for Si developed by Lee (2007) v001 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_000 |
MEAM potential for Si system developed by Lenosky et al. (2000) v000 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_001 |
MEAM potential for Si system developed by Lenosky et al. (2000) v001 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_002 |
MEAM potential for Si system developed by Lenosky et al. (2000) v002 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_000 |
MEAM potential for Si-C developed by Wagner (2007) v000 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_001 |
MEAM potential for Si-C developed by Wagner (2007) v001 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_002 |
MEAM potential for Si-C developed by Wagner (2007) v002 |
view |
MFF_MistriotisFlytzanisFarantos_1989_Si__MO_080526771943_001 |
MFF potential for Si developed by Mistriotis, Flytzanis and Farantos (1989) v001 |
view |
Sim_LAMMPS_ADP_StarikovGordeevLysogorskiy_2020_SiAuAl__SM_113843830602_000 |
LAMMPS ADP potential for the Si-Au-Al system developed by Starikov et al. (2020) v000 |
view |
Sim_LAMMPS_ADP_StarikovLopanitsynaSmirnova_2018_SiAu__SM_985135773293_000 |
LAMMPS ADP potential for the Si-Au system developed by Starikov et al. (2018) v000 |
view |
Sim_LAMMPS_EDIP_LucasBertolusPizzagalli_2009_SiC__SM_435704953434_000 |
LAMMPS EDIP potential for Si-C developed by Lucas, Bertolus, and Pizzagalli (2009) v000 |
view |
Sim_LAMMPS_GW_GaoWeber_2002_SiC__SM_606253546840_000 |
LAMMPS Gao-Weber potential for Si-C developed by Gao and Weber (2002) v000 |
view |
Sim_LAMMPS_GWZBL_Samolyuk_2016_SiC__SM_720598599889_000 |
LAMMPS Gao-Weber potential combined with a modified repulsive ZBL core function for the Si-C system developed by German Samolyuk (2016) v000 |
view |
Sim_LAMMPS_MEAM_CuiGaoCui_2012_LiSi__SM_562938628131_000 |
LAMMPS MEAM potential for Li-Si alloys developed by Cui et al. (2012) v000 |
view |
Sim_LAMMPS_MEAM_DuLenoskyHennig_2011_Si__SM_662785656123_000 |
LAMMPS Spline-based MEAM potential for Si system developed by Du et al. (2011) v000 |
view |
Sim_LAMMPS_MEAM_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__SM_656517352485_000 |
LAMMPS MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v000 |
view |
Sim_LAMMPS_MEAM_LenoskySadighAlonso_2000_Si__SM_622320990752_000 |
LAMMPS MEAM potential for Si system developed by Lenosky et al. (2000) v000 |
view |
Sim_LAMMPS_MEAM_Wagner_2007_SiC__SM_264944083668_000 |
LAMMPS MEAM potential for Si-C developed by Wagner (2007) v000 |
view |
Sim_LAMMPS_ModifiedTersoff_KumagaiIzumiHara_2007_Si__SM_773333226968_000 |
LAMMPS Modified Tersoff potential for Si by Kumagai et al. (2007) v000 |
view |
Sim_LAMMPS_ModifiedTersoff_PurjaPunMishin_2017_Si__SM_184524061456_000 |
LAMMPS Modified Tersoff potential for Si developed by Purja Pun and Mishin (2017) v000 |
view |
Sim_LAMMPS_ReaxFF_BrugnoliMiyataniAkaji_SiCeNaClHO_2023__SM_282799919035_000 |
LAMMPS ReaxFF potential for Ceria/Silica/Water/NaCl developed by Brugnoli et al. (2023) v000 |
view |
Sim_LAMMPS_ReaxFF_ManzanoMoeiniMarinelli_2012_CaSiOH__SM_714124634215_000 |
LAMMPS ReaxFF potential for Ca-Si-O-H systems developed by Manzano et al. (2012) v000 |
view |
Sim_LAMMPS_TersoffZBL_DevanathanDiazdelaRubiaWeber_1998_SiC__SM_578912636995_000 |
LAMMPS Tersoff-ZBL potential for Si-C developed by Devanathan, Diaz de la Rubia, and Weber (1998) v000 |
view |
Sim_LAMMPS_Vashishta_BroughtonMeliVashishta_1997_SiO__SM_422553794879_000 |
LAMMPS Vashishta potential for the Si-O system developed by Broughton et al. (1997) v000 |
view |
Sim_LAMMPS_Vashishta_NakanoKaliaVashishta_1994_SiO__SM_503555646986_000 |
LAMMPS Vashishta potential for the Si-O system developed by Nakano et al. (1994) v000 |
view |
Sim_LAMMPS_Vashishta_VashishtaKaliaNakano_2007_SiC__SM_196548226654_000 |
LAMMPS Vashishta potential for the Si-C system developed by Vashishta et al. (2007) v000 |
view |
Sim_LAMMPS_Vashishta_VashishtaKaliaRino_1990_SiO__SM_887826436433_000 |
LAMMPS Vashishta potential for the Si-O system developed by Vashishta et al. (1990) v000 |
view |
SNAP_ZuoChenLi_2019_Si__MO_869330304805_000 |
A spectral neighbor analysis potential for Si developed by Yunxing Zuo v000 |
view |
SNAP_ZuoChenLi_2019quadratic_Si__MO_721469752060_000 |
A quadratic spectral neighbor analysis potential for Si developed by Yunxing Zuo v000 |
view |
SW_BalamaneHaliciogluTiller_1992_Si__MO_113686039439_004 |
Stillinger-Weber potential for Si developed by Balamane, Halicioglu and Tiller (1992) v004 |
view |
SW_BalamaneHaliciogluTiller_1992_Si__MO_113686039439_005 |
Stillinger-Weber potential for Si developed by Balamane, Halicioglu and Tiller (1992) v005 |
view |
SW_BalamaneHauchShi_2017Brittle_Si__MO_381114941873_002 |
Stillinger-Weber potential for brittle Si combining the modifications of Balamane et al. (1992) and Hauch et al. (1999) v002 |
view |
SW_BalamaneHauchShi_2017Brittle_Si__MO_381114941873_003 |
Stillinger-Weber potential for brittle Si combining the modifications of Balamane et al. (1992) and Hauch et al. (1999) v003 |
view |
SW_HauchHollandMarder_1999Brittle_Si__MO_119167353542_004 |
Stillinger-Weber potential for brittle Si due to Hauch et al. (1999) v004 |
view |
SW_HauchHollandMarder_1999Brittle_Si__MO_119167353542_005 |
Stillinger-Weber potential for brittle Si due to Hauch et al. (1999) v005 |
view |
SW_LeeHwang_2012GGA_Si__MO_040570764911_000 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); GGA parameterization v000 |
view |
SW_LeeHwang_2012GGA_Si__MO_040570764911_001 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); GGA parameterization v001 |
view |
SW_LeeHwang_2012LDA_Si__MO_517338295712_000 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); LDA parameterization v000 |
view |
SW_LeeHwang_2012LDA_Si__MO_517338295712_001 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); LDA parameterization v001 |
view |
SW_StillingerWeber_1985_Si__MO_405512056662_005 |
Stillinger-Weber potential for Si due to Stillinger and Weber (1985) v005 |
view |
SW_StillingerWeber_1985_Si__MO_405512056662_006 |
Stillinger-Weber potential for Si due to Stillinger and Weber (1985) v006 |
view |
SW_ZhangXieHu_2014OptimizedSW1_Si__MO_800412945727_004 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW1' v004 |
view |
SW_ZhangXieHu_2014OptimizedSW1_Si__MO_800412945727_005 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW1' v005 |
view |
SW_ZhangXieHu_2014OptimizedSW2_Si__MO_475612090600_004 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW2' v004 |
view |
SW_ZhangXieHu_2014OptimizedSW2_Si__MO_475612090600_005 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW2' v005 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_003 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v003 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_004 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v004 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_005 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v005 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_002 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v002 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_003 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v003 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_004 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v004 |
view |
Tersoff_LAMMPS_MunetohMotookaMoriguchi_2007_SiO__MO_501246546792_000 |
Tersoff-style three-body potential for SiO developed by Munetoh et al. (2007) v000 |
view |
Tersoff_LAMMPS_PlummerTucker_2019_TiSiC__MO_751442731010_000 |
Tersoff-style three-body potential for TiSiC developed by Plummer and Tucker (2019) v000 |
view |
Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_002 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v002 |
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Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_003 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v003 |
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Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_004 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v004 |
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Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_002 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v002 |
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Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_003 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v003 |
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Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_004 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v004 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiC__MO_171585019474_002 |
Tersoff-style three-body potential for SiC developed by Tersoff (1989) v002 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiC__MO_171585019474_003 |
Tersoff-style three-body potential for SiC developed by Tersoff (1989) v003 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_002 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v002 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_003 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v003 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_004 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v004 |
view |
Tersoff_LAMMPS_Tersoff_1990_SiC__MO_444207127575_000 |
Tersoff-style three-body potential for SiC developed by Tersoff (1990) v000 |
view |
Tersoff_LAMMPS_Tersoff_1994_SiC__MO_794973922560_000 |
Tersoff-style three-body potential for SiC developed by Tersoff (1994) v000 |
view |
ThreeBodyBondOrder_KDS_KhorDasSarma_1988_Si__MO_722489435928_000 |
Three-body cluster potential for Si by Khor and Das Sarma (1988) v000 |
view |
ThreeBodyBondOrder_PPM_PurjaPunMishin_2017_Si__MO_566683736730_000 |
Three-body bond-order potential for Si by Purja Pun and Mishin (2017) v000 |
view |
ThreeBodyBondOrder_WR_WangRockett_1991_Si__MO_081872846741_000 |
Three-body bond-order potential for Si by Wang and Rockett (1991) v000 |
view |
ThreeBodyCluster_BH_BiswasHamann_1987_Si__MO_019616213550_000 |
Three-body cluster potential for Si by Biswas and Hamann (1987) v000 |
view |
ThreeBodyCluster_Gong_Gong_1993_Si__MO_407755720412_000 |
Three-body cluster potential for Si by Gong (1993) v000 |
view |
ThreeBodyCluster_KP_KaxirasPandey_1988_Si__MO_072486242437_000 |
Three-body cluster potential for Si by Kaxiras and Pandey (1988) v000 |
view |
ThreeBodyCluster_SRS_StephensonRadnySmith_1996_Si__MO_604248666067_000 |
Three-body cluster potential for Si by Stephenson, Radny and Smith (1996) v000 |
view |
TorchML_MACE_GuptaTadmorMartiniani_2024_Si__MO_781946209112_000 |
Parallel MACE Equivariant GNN for Si developed by Gupta et al. (2024) v000 |
view |
TorchML_NequIP_GuptaTadmorMartiniani_2024_Si__MO_196181738937_000 |
Parallel NequIP Equivariant GNN for Si developed by Gupta et al. (2024) v000 |
view |
Model |
Model Title |
Test Result |
EDIP_BOP_Bazant_Kaxiras_Si__MO_958932894036_001 |
Original EDIP potential for elemental silicon. |
view |
Four_Body_Mistriotis_Flytzanis_Farantos_Si__MO_080526771943_000 |
A four-body Mistriotis-Flytzanis-Farantos Model for Silicon |
view |
LennardJones612_UniversalShifted__MO_959249795837_002 |
Efficient "universal" shifted Lennard-Jones model for all KIM API supported species |
view |
Tersoff_LAMMPS_Erhart_Albe_CSi__MO_903987585848_001 |
Tersoff-style three-body potential for SiC by Erhart/Albe |
view |
Tersoff_LAMMPS_Erhart_Albe_CSi__MO_903987585848_002 |
Tersoff-style three-body potential for SiC by Erhart/Albe |
view |
Tersoff_LAMMPS_Erhart_Albe_SiII_CSi__MO_408791041969_000 |
Tersoff-style three-body potential for SiC by Erhart/Albe, parameter set Si II |
view |
Tersoff_LAMMPS_Erhart_Albe_SiII_CSi__MO_408791041969_001 |
Tersoff-style three-body potential for SiC by Erhart/Albe, parameter set Si II |
view |
Tersoff_LAMMPS_Tersoff_PRB37_1988_Si__MO_245095684871_000 |
Tersoff's silicon potential (PRB 37, 1988) |
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Tersoff_LAMMPS_Tersoff_PRB37_1988_Si__MO_245095684871_001 |
Tersoff's silicon potential (PRB 37, 1988) |
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Tersoff_LAMMPS_Tersoff_PRB38_1988_Si__MO_186459956893_000 |
Tersoff's silicon potential (PRB 38, 1988) |
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Tersoff_LAMMPS_Tersoff_PRB38_1988_Si__MO_186459956893_001 |
Tersoff's silicon potential (PRB 38, 1988) |
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Tersoff_LAMMPS_Tersoff_PRB39_1989_CSi__MO_171585019474_000 |
Tersoff's silicon carbide potential (PRB 39, 1989) |
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Tersoff_LAMMPS_Tersoff_PRB39_1989_CSi__MO_171585019474_001 |
Tersoff's silicon carbide potential (PRB 39, 1989) |
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Tersoff_LAMMPS_Tersoff_PRB39_1989_GeSi__MO_350526375143_000 |
Tersoff's silicon germanium potential (PRB 39, 1989) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_GeSi__MO_350526375143_001 |
Tersoff's silicon germanium potential (PRB 39, 1989) |
view |
Three_Body_Stillinger_Weber_Balamane_Hauch_Brittle_Si__MO_381114941873_000 |
Three Body Stillinger Weber Combined Balamane and Hauch Brittle Silicon |
view |
Three_Body_Stillinger_Weber_Balamane_Hauch_Brittle_Si__MO_381114941873_001 |
Three Body Stillinger Weber Combined Balamane and Hauch Brittle Silicon |
view |
Three_Body_Stillinger_Weber_Balamane_Si__MO_113686039439_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Balamane et al |
view |
Three_Body_Stillinger_Weber_Balamane_Si__MO_113686039439_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Balamane et al |
view |
Three_Body_Stillinger_Weber_Hauch_Brittle_Si__MO_119167353542_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Hauch et al |
view |
Three_Body_Stillinger_Weber_Hauch_Brittle_Si__MO_119167353542_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Hauch et al |
view |
Three_Body_Stillinger_Weber_Si__MO_405512056662_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon |
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Three_Body_Stillinger_Weber_Si__MO_405512056662_004 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon |
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Three_Body_Stillinger_Weber_Zhang_Silicene_Model1_Si__MO_800412945727_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
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Three_Body_Stillinger_Weber_Zhang_Silicene_Model1_Si__MO_800412945727_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
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Three_Body_Stillinger_Weber_Zhang_Silicene_Model2_Si__MO_475612090600_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
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Three_Body_Stillinger_Weber_Zhang_Silicene_Model2_Si__MO_475612090600_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
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Model |
Model Title |
Test Result |
EDIP_JustoBazantKaxiras_1998_Si__MO_958932894036_002 |
EDIP model for Si developed by Justo et al. (1998) v002 |
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EDIP_LAMMPS_JiangMorganSzlufarska_2012_SiC__MO_667792548433_000 |
EDIP model for SiC developed by Jiang, Morgan, and Szlufarska (2012) v000 |
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EDIP_LAMMPS_JustoBazantKaxiras_1998_Si__MO_315965276297_000 |
EDIP model for Si developed by Justo et al. (1998) v000 |
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EDIP_LAMMPS_LucasBertolusPizzagalli_2009_SiC__MO_634310164305_000 |
EDIP potential for Si-C developed by Lucas, Bertolus, and Pizzagalli (2009) v000 |
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LJ_ElliottAkerson_2015_Universal__MO_959249795837_003 |
Efficient 'universal' shifted Lennard-Jones model for all KIM API supported species developed by Elliott and Akerson (2015) v003 |
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MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_000 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v000 |
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MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_001 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v001 |
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MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_002 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v002 |
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MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_000 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v000 |
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MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_001 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v001 |
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MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_002 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v002 |
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MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_000 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v000 |
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MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_001 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v001 |
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MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_002 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v002 |
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MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_000 |
MEAM potential for Si developed by Huang et al. (2018) v000 |
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MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_001 |
MEAM potential for Si developed by Huang et al. (2018) v001 |
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MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_002 |
MEAM potential for Si developed by Huang et al. (2018) v002 |
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MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_000 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v000 |
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MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_001 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v001 |
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MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_002 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v002 |
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MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_000 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v000 |
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MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_001 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v001 |
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MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_002 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v002 |
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MEAM_LAMMPS_Lee_2007_Si__MO_774917820956_000 |
MEAM Potential for Si developed by Lee (2007) v000 |
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MEAM_LAMMPS_Lee_2007_Si__MO_774917820956_001 |
MEAM Potential for Si developed by Lee (2007) v001 |
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MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_000 |
MEAM potential for Si system developed by Lenosky et al. (2000) v000 |
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MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_001 |
MEAM potential for Si system developed by Lenosky et al. (2000) v001 |
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MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_002 |
MEAM potential for Si system developed by Lenosky et al. (2000) v002 |
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MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_000 |
MEAM potential for Si-C developed by Wagner (2007) v000 |
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MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_001 |
MEAM potential for Si-C developed by Wagner (2007) v001 |
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MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_002 |
MEAM potential for Si-C developed by Wagner (2007) v002 |
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MFF_MistriotisFlytzanisFarantos_1989_Si__MO_080526771943_001 |
MFF potential for Si developed by Mistriotis, Flytzanis and Farantos (1989) v001 |
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Sim_LAMMPS_ADP_StarikovGordeevLysogorskiy_2020_SiAuAl__SM_113843830602_000 |
LAMMPS ADP potential for the Si-Au-Al system developed by Starikov et al. (2020) v000 |
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Sim_LAMMPS_ADP_StarikovLopanitsynaSmirnova_2018_SiAu__SM_985135773293_000 |
LAMMPS ADP potential for the Si-Au system developed by Starikov et al. (2018) v000 |
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Sim_LAMMPS_EDIP_LucasBertolusPizzagalli_2009_SiC__SM_435704953434_000 |
LAMMPS EDIP potential for Si-C developed by Lucas, Bertolus, and Pizzagalli (2009) v000 |
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Sim_LAMMPS_GW_GaoWeber_2002_SiC__SM_606253546840_000 |
LAMMPS Gao-Weber potential for Si-C developed by Gao and Weber (2002) v000 |
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Sim_LAMMPS_GWZBL_Samolyuk_2016_SiC__SM_720598599889_000 |
LAMMPS Gao-Weber potential combined with a modified repulsive ZBL core function for the Si-C system developed by German Samolyuk (2016) v000 |
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Sim_LAMMPS_MEAM_CuiGaoCui_2012_LiSi__SM_562938628131_000 |
LAMMPS MEAM potential for Li-Si alloys developed by Cui et al. (2012) v000 |
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Sim_LAMMPS_MEAM_DuLenoskyHennig_2011_Si__SM_662785656123_000 |
LAMMPS Spline-based MEAM potential for Si system developed by Du et al. (2011) v000 |
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Sim_LAMMPS_MEAM_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__SM_656517352485_000 |
LAMMPS MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v000 |
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Sim_LAMMPS_MEAM_LenoskySadighAlonso_2000_Si__SM_622320990752_000 |
LAMMPS MEAM potential for Si system developed by Lenosky et al. (2000) v000 |
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Sim_LAMMPS_MEAM_Wagner_2007_SiC__SM_264944083668_000 |
LAMMPS MEAM potential for Si-C developed by Wagner (2007) v000 |
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Sim_LAMMPS_ModifiedTersoff_KumagaiIzumiHara_2007_Si__SM_773333226968_000 |
LAMMPS Modified Tersoff potential for Si by Kumagai et al. (2007) v000 |
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Sim_LAMMPS_ModifiedTersoff_PurjaPunMishin_2017_Si__SM_184524061456_000 |
LAMMPS Modified Tersoff potential for Si developed by Purja Pun and Mishin (2017) v000 |
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Sim_LAMMPS_ReaxFF_BrugnoliMiyataniAkaji_SiCeNaClHO_2023__SM_282799919035_000 |
LAMMPS ReaxFF potential for Ceria/Silica/Water/NaCl developed by Brugnoli et al. (2023) v000 |
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Sim_LAMMPS_ReaxFF_ManzanoMoeiniMarinelli_2012_CaSiOH__SM_714124634215_000 |
LAMMPS ReaxFF potential for Ca-Si-O-H systems developed by Manzano et al. (2012) v000 |
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Sim_LAMMPS_TersoffZBL_DevanathanDiazdelaRubiaWeber_1998_SiC__SM_578912636995_000 |
LAMMPS Tersoff-ZBL potential for Si-C developed by Devanathan, Diaz de la Rubia, and Weber (1998) v000 |
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Sim_LAMMPS_Vashishta_BroughtonMeliVashishta_1997_SiO__SM_422553794879_000 |
LAMMPS Vashishta potential for the Si-O system developed by Broughton et al. (1997) v000 |
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Sim_LAMMPS_Vashishta_NakanoKaliaVashishta_1994_SiO__SM_503555646986_000 |
LAMMPS Vashishta potential for the Si-O system developed by Nakano et al. (1994) v000 |
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Sim_LAMMPS_Vashishta_VashishtaKaliaNakano_2007_SiC__SM_196548226654_000 |
LAMMPS Vashishta potential for the Si-C system developed by Vashishta et al. (2007) v000 |
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Sim_LAMMPS_Vashishta_VashishtaKaliaRino_1990_SiO__SM_887826436433_000 |
LAMMPS Vashishta potential for the Si-O system developed by Vashishta et al. (1990) v000 |
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SNAP_ZuoChenLi_2019_Si__MO_869330304805_000 |
A spectral neighbor analysis potential for Si developed by Yunxing Zuo v000 |
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SNAP_ZuoChenLi_2019quadratic_Si__MO_721469752060_000 |
A quadratic spectral neighbor analysis potential for Si developed by Yunxing Zuo v000 |
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SW_BalamaneHaliciogluTiller_1992_Si__MO_113686039439_004 |
Stillinger-Weber potential for Si developed by Balamane, Halicioglu and Tiller (1992) v004 |
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SW_BalamaneHaliciogluTiller_1992_Si__MO_113686039439_005 |
Stillinger-Weber potential for Si developed by Balamane, Halicioglu and Tiller (1992) v005 |
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SW_BalamaneHauchShi_2017Brittle_Si__MO_381114941873_002 |
Stillinger-Weber potential for brittle Si combining the modifications of Balamane et al. (1992) and Hauch et al. (1999) v002 |
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SW_BalamaneHauchShi_2017Brittle_Si__MO_381114941873_003 |
Stillinger-Weber potential for brittle Si combining the modifications of Balamane et al. (1992) and Hauch et al. (1999) v003 |
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SW_HauchHollandMarder_1999Brittle_Si__MO_119167353542_004 |
Stillinger-Weber potential for brittle Si due to Hauch et al. (1999) v004 |
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SW_HauchHollandMarder_1999Brittle_Si__MO_119167353542_005 |
Stillinger-Weber potential for brittle Si due to Hauch et al. (1999) v005 |
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SW_LeeHwang_2012GGA_Si__MO_040570764911_000 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); GGA parameterization v000 |
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SW_LeeHwang_2012GGA_Si__MO_040570764911_001 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); GGA parameterization v001 |
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SW_LeeHwang_2012LDA_Si__MO_517338295712_000 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); LDA parameterization v000 |
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SW_LeeHwang_2012LDA_Si__MO_517338295712_001 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); LDA parameterization v001 |
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SW_StillingerWeber_1985_Si__MO_405512056662_005 |
Stillinger-Weber potential for Si due to Stillinger and Weber (1985) v005 |
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SW_StillingerWeber_1985_Si__MO_405512056662_006 |
Stillinger-Weber potential for Si due to Stillinger and Weber (1985) v006 |
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SW_ZhangXieHu_2014OptimizedSW1_Si__MO_800412945727_004 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW1' v004 |
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SW_ZhangXieHu_2014OptimizedSW1_Si__MO_800412945727_005 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW1' v005 |
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SW_ZhangXieHu_2014OptimizedSW2_Si__MO_475612090600_004 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW2' v004 |
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SW_ZhangXieHu_2014OptimizedSW2_Si__MO_475612090600_005 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW2' v005 |
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Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_003 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v003 |
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Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_004 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v004 |
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Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_005 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v005 |
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Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_002 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v002 |
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Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_003 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v003 |
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Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_004 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v004 |
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Tersoff_LAMMPS_MunetohMotookaMoriguchi_2007_SiO__MO_501246546792_000 |
Tersoff-style three-body potential for SiO developed by Munetoh et al. (2007) v000 |
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Tersoff_LAMMPS_PlummerTucker_2019_TiSiC__MO_751442731010_000 |
Tersoff-style three-body potential for TiSiC developed by Plummer and Tucker (2019) v000 |
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Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_002 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v002 |
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Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_003 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v003 |
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Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_004 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v004 |
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Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_002 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v002 |
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Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_003 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v003 |
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Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_004 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v004 |
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Tersoff_LAMMPS_Tersoff_1989_SiC__MO_171585019474_002 |
Tersoff-style three-body potential for SiC developed by Tersoff (1989) v002 |
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Tersoff_LAMMPS_Tersoff_1989_SiC__MO_171585019474_003 |
Tersoff-style three-body potential for SiC developed by Tersoff (1989) v003 |
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Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_002 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v002 |
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Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_003 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v003 |
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Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_004 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v004 |
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Tersoff_LAMMPS_Tersoff_1990_SiC__MO_444207127575_000 |
Tersoff-style three-body potential for SiC developed by Tersoff (1990) v000 |
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Tersoff_LAMMPS_Tersoff_1994_SiC__MO_794973922560_000 |
Tersoff-style three-body potential for SiC developed by Tersoff (1994) v000 |
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ThreeBodyBondOrder_KDS_KhorDasSarma_1988_Si__MO_722489435928_000 |
Three-body cluster potential for Si by Khor and Das Sarma (1988) v000 |
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ThreeBodyBondOrder_PPM_PurjaPunMishin_2017_Si__MO_566683736730_000 |
Three-body bond-order potential for Si by Purja Pun and Mishin (2017) v000 |
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ThreeBodyBondOrder_WR_WangRockett_1991_Si__MO_081872846741_000 |
Three-body bond-order potential for Si by Wang and Rockett (1991) v000 |
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ThreeBodyCluster_BH_BiswasHamann_1987_Si__MO_019616213550_000 |
Three-body cluster potential for Si by Biswas and Hamann (1987) v000 |
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ThreeBodyCluster_Gong_Gong_1993_Si__MO_407755720412_000 |
Three-body cluster potential for Si by Gong (1993) v000 |
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ThreeBodyCluster_KP_KaxirasPandey_1988_Si__MO_072486242437_000 |
Three-body cluster potential for Si by Kaxiras and Pandey (1988) v000 |
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ThreeBodyCluster_SRS_StephensonRadnySmith_1996_Si__MO_604248666067_000 |
Three-body cluster potential for Si by Stephenson, Radny and Smith (1996) v000 |
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TorchML_MACE_GuptaTadmorMartiniani_2024_Si__MO_781946209112_000 |
Parallel MACE Equivariant GNN for Si developed by Gupta et al. (2024) v000 |
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TorchML_NequIP_GuptaTadmorMartiniani_2024_Si__MO_196181738937_000 |
Parallel NequIP Equivariant GNN for Si developed by Gupta et al. (2024) v000 |
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Model |
Model Title |
Test Result |
EDIP_BOP_Bazant_Kaxiras_Si__MO_958932894036_001 |
Original EDIP potential for elemental silicon. |
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Four_Body_Mistriotis_Flytzanis_Farantos_Si__MO_080526771943_000 |
A four-body Mistriotis-Flytzanis-Farantos Model for Silicon |
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LennardJones612_UniversalShifted__MO_959249795837_002 |
Efficient "universal" shifted Lennard-Jones model for all KIM API supported species |
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Tersoff_LAMMPS_Erhart_Albe_CSi__MO_903987585848_001 |
Tersoff-style three-body potential for SiC by Erhart/Albe |
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Tersoff_LAMMPS_Erhart_Albe_CSi__MO_903987585848_002 |
Tersoff-style three-body potential for SiC by Erhart/Albe |
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Tersoff_LAMMPS_Erhart_Albe_SiII_CSi__MO_408791041969_000 |
Tersoff-style three-body potential for SiC by Erhart/Albe, parameter set Si II |
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Tersoff_LAMMPS_Erhart_Albe_SiII_CSi__MO_408791041969_001 |
Tersoff-style three-body potential for SiC by Erhart/Albe, parameter set Si II |
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Tersoff_LAMMPS_Tersoff_PRB37_1988_Si__MO_245095684871_000 |
Tersoff's silicon potential (PRB 37, 1988) |
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Tersoff_LAMMPS_Tersoff_PRB37_1988_Si__MO_245095684871_001 |
Tersoff's silicon potential (PRB 37, 1988) |
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Tersoff_LAMMPS_Tersoff_PRB38_1988_Si__MO_186459956893_000 |
Tersoff's silicon potential (PRB 38, 1988) |
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Tersoff_LAMMPS_Tersoff_PRB38_1988_Si__MO_186459956893_001 |
Tersoff's silicon potential (PRB 38, 1988) |
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Tersoff_LAMMPS_Tersoff_PRB39_1989_CSi__MO_171585019474_000 |
Tersoff's silicon carbide potential (PRB 39, 1989) |
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Tersoff_LAMMPS_Tersoff_PRB39_1989_CSi__MO_171585019474_001 |
Tersoff's silicon carbide potential (PRB 39, 1989) |
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Tersoff_LAMMPS_Tersoff_PRB39_1989_GeSi__MO_350526375143_000 |
Tersoff's silicon germanium potential (PRB 39, 1989) |
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Tersoff_LAMMPS_Tersoff_PRB39_1989_GeSi__MO_350526375143_001 |
Tersoff's silicon germanium potential (PRB 39, 1989) |
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Three_Body_Stillinger_Weber_Balamane_Hauch_Brittle_Si__MO_381114941873_000 |
Three Body Stillinger Weber Combined Balamane and Hauch Brittle Silicon |
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Three_Body_Stillinger_Weber_Balamane_Hauch_Brittle_Si__MO_381114941873_001 |
Three Body Stillinger Weber Combined Balamane and Hauch Brittle Silicon |
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Three_Body_Stillinger_Weber_Balamane_Si__MO_113686039439_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Balamane et al |
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Three_Body_Stillinger_Weber_Balamane_Si__MO_113686039439_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Balamane et al |
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Three_Body_Stillinger_Weber_Hauch_Brittle_Si__MO_119167353542_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Hauch et al |
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Three_Body_Stillinger_Weber_Hauch_Brittle_Si__MO_119167353542_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Hauch et al |
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Three_Body_Stillinger_Weber_Si__MO_405512056662_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon |
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Three_Body_Stillinger_Weber_Si__MO_405512056662_004 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon |
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Three_Body_Stillinger_Weber_Zhang_Silicene_Model1_Si__MO_800412945727_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
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Three_Body_Stillinger_Weber_Zhang_Silicene_Model1_Si__MO_800412945727_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
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Three_Body_Stillinger_Weber_Zhang_Silicene_Model2_Si__MO_475612090600_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
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Three_Body_Stillinger_Weber_Zhang_Silicene_Model2_Si__MO_475612090600_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
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Model |
Model Title |
Test Result |
EDIP_JustoBazantKaxiras_1998_Si__MO_958932894036_002 |
EDIP model for Si developed by Justo et al. (1998) v002 |
view |
EDIP_LAMMPS_JiangMorganSzlufarska_2012_SiC__MO_667792548433_000 |
EDIP model for SiC developed by Jiang, Morgan, and Szlufarska (2012) v000 |
view |
EDIP_LAMMPS_JustoBazantKaxiras_1998_Si__MO_315965276297_000 |
EDIP model for Si developed by Justo et al. (1998) v000 |
view |
EDIP_LAMMPS_LucasBertolusPizzagalli_2009_SiC__MO_634310164305_000 |
EDIP potential for Si-C developed by Lucas, Bertolus, and Pizzagalli (2009) v000 |
view |
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003 |
Efficient 'universal' shifted Lennard-Jones model for all KIM API supported species developed by Elliott and Akerson (2015) v003 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_000 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v000 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_001 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v001 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_002 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v002 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_000 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v000 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_001 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v001 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_002 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v002 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_000 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v000 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_001 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v001 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_002 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v002 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_000 |
MEAM potential for Si developed by Huang et al. (2018) v000 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_001 |
MEAM potential for Si developed by Huang et al. (2018) v001 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_002 |
MEAM potential for Si developed by Huang et al. (2018) v002 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_000 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v000 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_001 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v001 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_002 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v002 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_000 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v000 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_001 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v001 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_002 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v002 |
view |
MEAM_LAMMPS_Lee_2007_Si__MO_774917820956_000 |
MEAM Potential for Si developed by Lee (2007) v000 |
view |
MEAM_LAMMPS_Lee_2007_Si__MO_774917820956_001 |
MEAM Potential for Si developed by Lee (2007) v001 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_000 |
MEAM potential for Si system developed by Lenosky et al. (2000) v000 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_001 |
MEAM potential for Si system developed by Lenosky et al. (2000) v001 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_002 |
MEAM potential for Si system developed by Lenosky et al. (2000) v002 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_000 |
MEAM potential for Si-C developed by Wagner (2007) v000 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_001 |
MEAM potential for Si-C developed by Wagner (2007) v001 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_002 |
MEAM potential for Si-C developed by Wagner (2007) v002 |
view |
MFF_MistriotisFlytzanisFarantos_1989_Si__MO_080526771943_001 |
MFF potential for Si developed by Mistriotis, Flytzanis and Farantos (1989) v001 |
view |
Sim_LAMMPS_ADP_StarikovGordeevLysogorskiy_2020_SiAuAl__SM_113843830602_000 |
LAMMPS ADP potential for the Si-Au-Al system developed by Starikov et al. (2020) v000 |
view |
Sim_LAMMPS_ADP_StarikovLopanitsynaSmirnova_2018_SiAu__SM_985135773293_000 |
LAMMPS ADP potential for the Si-Au system developed by Starikov et al. (2018) v000 |
view |
Sim_LAMMPS_EDIP_LucasBertolusPizzagalli_2009_SiC__SM_435704953434_000 |
LAMMPS EDIP potential for Si-C developed by Lucas, Bertolus, and Pizzagalli (2009) v000 |
view |
Sim_LAMMPS_GW_GaoWeber_2002_SiC__SM_606253546840_000 |
LAMMPS Gao-Weber potential for Si-C developed by Gao and Weber (2002) v000 |
view |
Sim_LAMMPS_GWZBL_Samolyuk_2016_SiC__SM_720598599889_000 |
LAMMPS Gao-Weber potential combined with a modified repulsive ZBL core function for the Si-C system developed by German Samolyuk (2016) v000 |
view |
Sim_LAMMPS_MEAM_CuiGaoCui_2012_LiSi__SM_562938628131_000 |
LAMMPS MEAM potential for Li-Si alloys developed by Cui et al. (2012) v000 |
view |
Sim_LAMMPS_MEAM_DuLenoskyHennig_2011_Si__SM_662785656123_000 |
LAMMPS Spline-based MEAM potential for Si system developed by Du et al. (2011) v000 |
view |
Sim_LAMMPS_MEAM_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__SM_656517352485_000 |
LAMMPS MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v000 |
view |
Sim_LAMMPS_MEAM_LenoskySadighAlonso_2000_Si__SM_622320990752_000 |
LAMMPS MEAM potential for Si system developed by Lenosky et al. (2000) v000 |
view |
Sim_LAMMPS_MEAM_Wagner_2007_SiC__SM_264944083668_000 |
LAMMPS MEAM potential for Si-C developed by Wagner (2007) v000 |
view |
Sim_LAMMPS_ModifiedTersoff_KumagaiIzumiHara_2007_Si__SM_773333226968_000 |
LAMMPS Modified Tersoff potential for Si by Kumagai et al. (2007) v000 |
view |
Sim_LAMMPS_ModifiedTersoff_PurjaPunMishin_2017_Si__SM_184524061456_000 |
LAMMPS Modified Tersoff potential for Si developed by Purja Pun and Mishin (2017) v000 |
view |
Sim_LAMMPS_ReaxFF_BrugnoliMiyataniAkaji_SiCeNaClHO_2023__SM_282799919035_000 |
LAMMPS ReaxFF potential for Ceria/Silica/Water/NaCl developed by Brugnoli et al. (2023) v000 |
view |
Sim_LAMMPS_ReaxFF_ManzanoMoeiniMarinelli_2012_CaSiOH__SM_714124634215_000 |
LAMMPS ReaxFF potential for Ca-Si-O-H systems developed by Manzano et al. (2012) v000 |
view |
Sim_LAMMPS_TersoffZBL_DevanathanDiazdelaRubiaWeber_1998_SiC__SM_578912636995_000 |
LAMMPS Tersoff-ZBL potential for Si-C developed by Devanathan, Diaz de la Rubia, and Weber (1998) v000 |
view |
Sim_LAMMPS_Vashishta_BroughtonMeliVashishta_1997_SiO__SM_422553794879_000 |
LAMMPS Vashishta potential for the Si-O system developed by Broughton et al. (1997) v000 |
view |
Sim_LAMMPS_Vashishta_NakanoKaliaVashishta_1994_SiO__SM_503555646986_000 |
LAMMPS Vashishta potential for the Si-O system developed by Nakano et al. (1994) v000 |
view |
Sim_LAMMPS_Vashishta_VashishtaKaliaNakano_2007_SiC__SM_196548226654_000 |
LAMMPS Vashishta potential for the Si-C system developed by Vashishta et al. (2007) v000 |
view |
Sim_LAMMPS_Vashishta_VashishtaKaliaRino_1990_SiO__SM_887826436433_000 |
LAMMPS Vashishta potential for the Si-O system developed by Vashishta et al. (1990) v000 |
view |
SNAP_ZuoChenLi_2019_Si__MO_869330304805_000 |
A spectral neighbor analysis potential for Si developed by Yunxing Zuo v000 |
view |
SNAP_ZuoChenLi_2019quadratic_Si__MO_721469752060_000 |
A quadratic spectral neighbor analysis potential for Si developed by Yunxing Zuo v000 |
view |
SW_BalamaneHaliciogluTiller_1992_Si__MO_113686039439_004 |
Stillinger-Weber potential for Si developed by Balamane, Halicioglu and Tiller (1992) v004 |
view |
SW_BalamaneHaliciogluTiller_1992_Si__MO_113686039439_005 |
Stillinger-Weber potential for Si developed by Balamane, Halicioglu and Tiller (1992) v005 |
view |
SW_BalamaneHauchShi_2017Brittle_Si__MO_381114941873_002 |
Stillinger-Weber potential for brittle Si combining the modifications of Balamane et al. (1992) and Hauch et al. (1999) v002 |
view |
SW_BalamaneHauchShi_2017Brittle_Si__MO_381114941873_003 |
Stillinger-Weber potential for brittle Si combining the modifications of Balamane et al. (1992) and Hauch et al. (1999) v003 |
view |
SW_HauchHollandMarder_1999Brittle_Si__MO_119167353542_004 |
Stillinger-Weber potential for brittle Si due to Hauch et al. (1999) v004 |
view |
SW_HauchHollandMarder_1999Brittle_Si__MO_119167353542_005 |
Stillinger-Weber potential for brittle Si due to Hauch et al. (1999) v005 |
view |
SW_LeeHwang_2012GGA_Si__MO_040570764911_000 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); GGA parameterization v000 |
view |
SW_LeeHwang_2012GGA_Si__MO_040570764911_001 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); GGA parameterization v001 |
view |
SW_LeeHwang_2012LDA_Si__MO_517338295712_000 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); LDA parameterization v000 |
view |
SW_LeeHwang_2012LDA_Si__MO_517338295712_001 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); LDA parameterization v001 |
view |
SW_StillingerWeber_1985_Si__MO_405512056662_005 |
Stillinger-Weber potential for Si due to Stillinger and Weber (1985) v005 |
view |
SW_StillingerWeber_1985_Si__MO_405512056662_006 |
Stillinger-Weber potential for Si due to Stillinger and Weber (1985) v006 |
view |
SW_ZhangXieHu_2014OptimizedSW1_Si__MO_800412945727_004 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW1' v004 |
view |
SW_ZhangXieHu_2014OptimizedSW1_Si__MO_800412945727_005 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW1' v005 |
view |
SW_ZhangXieHu_2014OptimizedSW2_Si__MO_475612090600_004 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW2' v004 |
view |
SW_ZhangXieHu_2014OptimizedSW2_Si__MO_475612090600_005 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW2' v005 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_003 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v003 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_004 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v004 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_005 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v005 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_002 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v002 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_003 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v003 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_004 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v004 |
view |
Tersoff_LAMMPS_MunetohMotookaMoriguchi_2007_SiO__MO_501246546792_000 |
Tersoff-style three-body potential for SiO developed by Munetoh et al. (2007) v000 |
view |
Tersoff_LAMMPS_PlummerTucker_2019_TiSiC__MO_751442731010_000 |
Tersoff-style three-body potential for TiSiC developed by Plummer and Tucker (2019) v000 |
view |
Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_002 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v002 |
view |
Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_003 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v003 |
view |
Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_004 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v004 |
view |
Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_002 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v002 |
view |
Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_003 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v003 |
view |
Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_004 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v004 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiC__MO_171585019474_002 |
Tersoff-style three-body potential for SiC developed by Tersoff (1989) v002 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiC__MO_171585019474_003 |
Tersoff-style three-body potential for SiC developed by Tersoff (1989) v003 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_002 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v002 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_003 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v003 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_004 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v004 |
view |
Tersoff_LAMMPS_Tersoff_1990_SiC__MO_444207127575_000 |
Tersoff-style three-body potential for SiC developed by Tersoff (1990) v000 |
view |
Tersoff_LAMMPS_Tersoff_1994_SiC__MO_794973922560_000 |
Tersoff-style three-body potential for SiC developed by Tersoff (1994) v000 |
view |
ThreeBodyBondOrder_KDS_KhorDasSarma_1988_Si__MO_722489435928_000 |
Three-body cluster potential for Si by Khor and Das Sarma (1988) v000 |
view |
ThreeBodyBondOrder_PPM_PurjaPunMishin_2017_Si__MO_566683736730_000 |
Three-body bond-order potential for Si by Purja Pun and Mishin (2017) v000 |
view |
ThreeBodyBondOrder_WR_WangRockett_1991_Si__MO_081872846741_000 |
Three-body bond-order potential for Si by Wang and Rockett (1991) v000 |
view |
ThreeBodyCluster_BH_BiswasHamann_1987_Si__MO_019616213550_000 |
Three-body cluster potential for Si by Biswas and Hamann (1987) v000 |
view |
ThreeBodyCluster_Gong_Gong_1993_Si__MO_407755720412_000 |
Three-body cluster potential for Si by Gong (1993) v000 |
view |
ThreeBodyCluster_KP_KaxirasPandey_1988_Si__MO_072486242437_000 |
Three-body cluster potential for Si by Kaxiras and Pandey (1988) v000 |
view |
ThreeBodyCluster_SRS_StephensonRadnySmith_1996_Si__MO_604248666067_000 |
Three-body cluster potential for Si by Stephenson, Radny and Smith (1996) v000 |
view |
TorchML_MACE_GuptaTadmorMartiniani_2024_Si__MO_781946209112_000 |
Parallel MACE Equivariant GNN for Si developed by Gupta et al. (2024) v000 |
view |
TorchML_NequIP_GuptaTadmorMartiniani_2024_Si__MO_196181738937_000 |
Parallel NequIP Equivariant GNN for Si developed by Gupta et al. (2024) v000 |
view |
Model |
Model Title |
Test Result |
EDIP_BOP_Bazant_Kaxiras_Si__MO_958932894036_001 |
Original EDIP potential for elemental silicon. |
view |
Four_Body_Mistriotis_Flytzanis_Farantos_Si__MO_080526771943_000 |
A four-body Mistriotis-Flytzanis-Farantos Model for Silicon |
view |
LennardJones612_UniversalShifted__MO_959249795837_002 |
Efficient "universal" shifted Lennard-Jones model for all KIM API supported species |
view |
Tersoff_LAMMPS_Erhart_Albe_CSi__MO_903987585848_001 |
Tersoff-style three-body potential for SiC by Erhart/Albe |
view |
Tersoff_LAMMPS_Erhart_Albe_CSi__MO_903987585848_002 |
Tersoff-style three-body potential for SiC by Erhart/Albe |
view |
Tersoff_LAMMPS_Erhart_Albe_SiII_CSi__MO_408791041969_000 |
Tersoff-style three-body potential for SiC by Erhart/Albe, parameter set Si II |
view |
Tersoff_LAMMPS_Erhart_Albe_SiII_CSi__MO_408791041969_001 |
Tersoff-style three-body potential for SiC by Erhart/Albe, parameter set Si II |
view |
Tersoff_LAMMPS_Tersoff_PRB37_1988_Si__MO_245095684871_000 |
Tersoff's silicon potential (PRB 37, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB37_1988_Si__MO_245095684871_001 |
Tersoff's silicon potential (PRB 37, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB38_1988_Si__MO_186459956893_000 |
Tersoff's silicon potential (PRB 38, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB38_1988_Si__MO_186459956893_001 |
Tersoff's silicon potential (PRB 38, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_CSi__MO_171585019474_000 |
Tersoff's silicon carbide potential (PRB 39, 1989) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_CSi__MO_171585019474_001 |
Tersoff's silicon carbide potential (PRB 39, 1989) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_GeSi__MO_350526375143_000 |
Tersoff's silicon germanium potential (PRB 39, 1989) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_GeSi__MO_350526375143_001 |
Tersoff's silicon germanium potential (PRB 39, 1989) |
view |
Three_Body_Stillinger_Weber_Balamane_Hauch_Brittle_Si__MO_381114941873_000 |
Three Body Stillinger Weber Combined Balamane and Hauch Brittle Silicon |
view |
Three_Body_Stillinger_Weber_Balamane_Hauch_Brittle_Si__MO_381114941873_001 |
Three Body Stillinger Weber Combined Balamane and Hauch Brittle Silicon |
view |
Three_Body_Stillinger_Weber_Balamane_Si__MO_113686039439_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Balamane et al |
view |
Three_Body_Stillinger_Weber_Balamane_Si__MO_113686039439_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Balamane et al |
view |
Three_Body_Stillinger_Weber_Hauch_Brittle_Si__MO_119167353542_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Hauch et al |
view |
Three_Body_Stillinger_Weber_Hauch_Brittle_Si__MO_119167353542_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Hauch et al |
view |
Three_Body_Stillinger_Weber_Si__MO_405512056662_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon |
view |
Three_Body_Stillinger_Weber_Si__MO_405512056662_004 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model1_Si__MO_800412945727_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model1_Si__MO_800412945727_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model2_Si__MO_475612090600_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model2_Si__MO_475612090600_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Model |
Model Title |
Test Result |
EDIP_JustoBazantKaxiras_1998_Si__MO_958932894036_002 |
EDIP model for Si developed by Justo et al. (1998) v002 |
view |
EDIP_LAMMPS_JiangMorganSzlufarska_2012_SiC__MO_667792548433_000 |
EDIP model for SiC developed by Jiang, Morgan, and Szlufarska (2012) v000 |
view |
EDIP_LAMMPS_JustoBazantKaxiras_1998_Si__MO_315965276297_000 |
EDIP model for Si developed by Justo et al. (1998) v000 |
view |
EDIP_LAMMPS_LucasBertolusPizzagalli_2009_SiC__MO_634310164305_000 |
EDIP potential for Si-C developed by Lucas, Bertolus, and Pizzagalli (2009) v000 |
view |
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003 |
Efficient 'universal' shifted Lennard-Jones model for all KIM API supported species developed by Elliott and Akerson (2015) v003 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_000 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v000 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_001 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v001 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_002 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v002 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_000 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v000 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_001 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v001 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_002 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v002 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_000 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v000 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_001 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v001 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_002 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v002 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_000 |
MEAM potential for Si developed by Huang et al. (2018) v000 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_001 |
MEAM potential for Si developed by Huang et al. (2018) v001 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_002 |
MEAM potential for Si developed by Huang et al. (2018) v002 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_000 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v000 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_001 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v001 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_002 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v002 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_000 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v000 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_001 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v001 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_002 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v002 |
view |
MEAM_LAMMPS_Lee_2007_Si__MO_774917820956_000 |
MEAM Potential for Si developed by Lee (2007) v000 |
view |
MEAM_LAMMPS_Lee_2007_Si__MO_774917820956_001 |
MEAM Potential for Si developed by Lee (2007) v001 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_000 |
MEAM potential for Si system developed by Lenosky et al. (2000) v000 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_001 |
MEAM potential for Si system developed by Lenosky et al. (2000) v001 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_002 |
MEAM potential for Si system developed by Lenosky et al. (2000) v002 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_000 |
MEAM potential for Si-C developed by Wagner (2007) v000 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_001 |
MEAM potential for Si-C developed by Wagner (2007) v001 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_002 |
MEAM potential for Si-C developed by Wagner (2007) v002 |
view |
MFF_MistriotisFlytzanisFarantos_1989_Si__MO_080526771943_001 |
MFF potential for Si developed by Mistriotis, Flytzanis and Farantos (1989) v001 |
view |
Sim_LAMMPS_ADP_StarikovGordeevLysogorskiy_2020_SiAuAl__SM_113843830602_000 |
LAMMPS ADP potential for the Si-Au-Al system developed by Starikov et al. (2020) v000 |
view |
Sim_LAMMPS_ADP_StarikovLopanitsynaSmirnova_2018_SiAu__SM_985135773293_000 |
LAMMPS ADP potential for the Si-Au system developed by Starikov et al. (2018) v000 |
view |
Sim_LAMMPS_EDIP_LucasBertolusPizzagalli_2009_SiC__SM_435704953434_000 |
LAMMPS EDIP potential for Si-C developed by Lucas, Bertolus, and Pizzagalli (2009) v000 |
view |
Sim_LAMMPS_GW_GaoWeber_2002_SiC__SM_606253546840_000 |
LAMMPS Gao-Weber potential for Si-C developed by Gao and Weber (2002) v000 |
view |
Sim_LAMMPS_GWZBL_Samolyuk_2016_SiC__SM_720598599889_000 |
LAMMPS Gao-Weber potential combined with a modified repulsive ZBL core function for the Si-C system developed by German Samolyuk (2016) v000 |
view |
Sim_LAMMPS_MEAM_CuiGaoCui_2012_LiSi__SM_562938628131_000 |
LAMMPS MEAM potential for Li-Si alloys developed by Cui et al. (2012) v000 |
view |
Sim_LAMMPS_MEAM_DuLenoskyHennig_2011_Si__SM_662785656123_000 |
LAMMPS Spline-based MEAM potential for Si system developed by Du et al. (2011) v000 |
view |
Sim_LAMMPS_MEAM_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__SM_656517352485_000 |
LAMMPS MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v000 |
view |
Sim_LAMMPS_MEAM_LenoskySadighAlonso_2000_Si__SM_622320990752_000 |
LAMMPS MEAM potential for Si system developed by Lenosky et al. (2000) v000 |
view |
Sim_LAMMPS_MEAM_Wagner_2007_SiC__SM_264944083668_000 |
LAMMPS MEAM potential for Si-C developed by Wagner (2007) v000 |
view |
Sim_LAMMPS_ModifiedTersoff_KumagaiIzumiHara_2007_Si__SM_773333226968_000 |
LAMMPS Modified Tersoff potential for Si by Kumagai et al. (2007) v000 |
view |
Sim_LAMMPS_ModifiedTersoff_PurjaPunMishin_2017_Si__SM_184524061456_000 |
LAMMPS Modified Tersoff potential for Si developed by Purja Pun and Mishin (2017) v000 |
view |
Sim_LAMMPS_ReaxFF_BrugnoliMiyataniAkaji_SiCeNaClHO_2023__SM_282799919035_000 |
LAMMPS ReaxFF potential for Ceria/Silica/Water/NaCl developed by Brugnoli et al. (2023) v000 |
view |
Sim_LAMMPS_ReaxFF_ManzanoMoeiniMarinelli_2012_CaSiOH__SM_714124634215_000 |
LAMMPS ReaxFF potential for Ca-Si-O-H systems developed by Manzano et al. (2012) v000 |
view |
Sim_LAMMPS_TersoffZBL_DevanathanDiazdelaRubiaWeber_1998_SiC__SM_578912636995_000 |
LAMMPS Tersoff-ZBL potential for Si-C developed by Devanathan, Diaz de la Rubia, and Weber (1998) v000 |
view |
Sim_LAMMPS_Vashishta_BroughtonMeliVashishta_1997_SiO__SM_422553794879_000 |
LAMMPS Vashishta potential for the Si-O system developed by Broughton et al. (1997) v000 |
view |
Sim_LAMMPS_Vashishta_NakanoKaliaVashishta_1994_SiO__SM_503555646986_000 |
LAMMPS Vashishta potential for the Si-O system developed by Nakano et al. (1994) v000 |
view |
Sim_LAMMPS_Vashishta_VashishtaKaliaNakano_2007_SiC__SM_196548226654_000 |
LAMMPS Vashishta potential for the Si-C system developed by Vashishta et al. (2007) v000 |
view |
Sim_LAMMPS_Vashishta_VashishtaKaliaRino_1990_SiO__SM_887826436433_000 |
LAMMPS Vashishta potential for the Si-O system developed by Vashishta et al. (1990) v000 |
view |
SNAP_ZuoChenLi_2019_Si__MO_869330304805_000 |
A spectral neighbor analysis potential for Si developed by Yunxing Zuo v000 |
view |
SNAP_ZuoChenLi_2019quadratic_Si__MO_721469752060_000 |
A quadratic spectral neighbor analysis potential for Si developed by Yunxing Zuo v000 |
view |
SW_BalamaneHaliciogluTiller_1992_Si__MO_113686039439_004 |
Stillinger-Weber potential for Si developed by Balamane, Halicioglu and Tiller (1992) v004 |
view |
SW_BalamaneHaliciogluTiller_1992_Si__MO_113686039439_005 |
Stillinger-Weber potential for Si developed by Balamane, Halicioglu and Tiller (1992) v005 |
view |
SW_BalamaneHauchShi_2017Brittle_Si__MO_381114941873_002 |
Stillinger-Weber potential for brittle Si combining the modifications of Balamane et al. (1992) and Hauch et al. (1999) v002 |
view |
SW_BalamaneHauchShi_2017Brittle_Si__MO_381114941873_003 |
Stillinger-Weber potential for brittle Si combining the modifications of Balamane et al. (1992) and Hauch et al. (1999) v003 |
view |
SW_HauchHollandMarder_1999Brittle_Si__MO_119167353542_004 |
Stillinger-Weber potential for brittle Si due to Hauch et al. (1999) v004 |
view |
SW_HauchHollandMarder_1999Brittle_Si__MO_119167353542_005 |
Stillinger-Weber potential for brittle Si due to Hauch et al. (1999) v005 |
view |
SW_LeeHwang_2012GGA_Si__MO_040570764911_000 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); GGA parameterization v000 |
view |
SW_LeeHwang_2012GGA_Si__MO_040570764911_001 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); GGA parameterization v001 |
view |
SW_LeeHwang_2012LDA_Si__MO_517338295712_000 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); LDA parameterization v000 |
view |
SW_LeeHwang_2012LDA_Si__MO_517338295712_001 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); LDA parameterization v001 |
view |
SW_StillingerWeber_1985_Si__MO_405512056662_005 |
Stillinger-Weber potential for Si due to Stillinger and Weber (1985) v005 |
view |
SW_StillingerWeber_1985_Si__MO_405512056662_006 |
Stillinger-Weber potential for Si due to Stillinger and Weber (1985) v006 |
view |
SW_ZhangXieHu_2014OptimizedSW1_Si__MO_800412945727_004 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW1' v004 |
view |
SW_ZhangXieHu_2014OptimizedSW1_Si__MO_800412945727_005 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW1' v005 |
view |
SW_ZhangXieHu_2014OptimizedSW2_Si__MO_475612090600_004 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW2' v004 |
view |
SW_ZhangXieHu_2014OptimizedSW2_Si__MO_475612090600_005 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW2' v005 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_003 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v003 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_004 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v004 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_005 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v005 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_002 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v002 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_003 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v003 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_004 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v004 |
view |
Tersoff_LAMMPS_MunetohMotookaMoriguchi_2007_SiO__MO_501246546792_000 |
Tersoff-style three-body potential for SiO developed by Munetoh et al. (2007) v000 |
view |
Tersoff_LAMMPS_PlummerTucker_2019_TiSiC__MO_751442731010_000 |
Tersoff-style three-body potential for TiSiC developed by Plummer and Tucker (2019) v000 |
view |
Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_002 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v002 |
view |
Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_003 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v003 |
view |
Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_004 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v004 |
view |
Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_002 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v002 |
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Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_003 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v003 |
view |
Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_004 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v004 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiC__MO_171585019474_002 |
Tersoff-style three-body potential for SiC developed by Tersoff (1989) v002 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiC__MO_171585019474_003 |
Tersoff-style three-body potential for SiC developed by Tersoff (1989) v003 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_002 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v002 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_003 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v003 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_004 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v004 |
view |
Tersoff_LAMMPS_Tersoff_1990_SiC__MO_444207127575_000 |
Tersoff-style three-body potential for SiC developed by Tersoff (1990) v000 |
view |
Tersoff_LAMMPS_Tersoff_1994_SiC__MO_794973922560_000 |
Tersoff-style three-body potential for SiC developed by Tersoff (1994) v000 |
view |
ThreeBodyBondOrder_KDS_KhorDasSarma_1988_Si__MO_722489435928_000 |
Three-body cluster potential for Si by Khor and Das Sarma (1988) v000 |
view |
ThreeBodyBondOrder_PPM_PurjaPunMishin_2017_Si__MO_566683736730_000 |
Three-body bond-order potential for Si by Purja Pun and Mishin (2017) v000 |
view |
ThreeBodyBondOrder_WR_WangRockett_1991_Si__MO_081872846741_000 |
Three-body bond-order potential for Si by Wang and Rockett (1991) v000 |
view |
ThreeBodyCluster_BH_BiswasHamann_1987_Si__MO_019616213550_000 |
Three-body cluster potential for Si by Biswas and Hamann (1987) v000 |
view |
ThreeBodyCluster_Gong_Gong_1993_Si__MO_407755720412_000 |
Three-body cluster potential for Si by Gong (1993) v000 |
view |
ThreeBodyCluster_KP_KaxirasPandey_1988_Si__MO_072486242437_000 |
Three-body cluster potential for Si by Kaxiras and Pandey (1988) v000 |
view |
ThreeBodyCluster_SRS_StephensonRadnySmith_1996_Si__MO_604248666067_000 |
Three-body cluster potential for Si by Stephenson, Radny and Smith (1996) v000 |
view |
TorchML_MACE_GuptaTadmorMartiniani_2024_Si__MO_781946209112_000 |
Parallel MACE Equivariant GNN for Si developed by Gupta et al. (2024) v000 |
view |
TorchML_NequIP_GuptaTadmorMartiniani_2024_Si__MO_196181738937_000 |
Parallel NequIP Equivariant GNN for Si developed by Gupta et al. (2024) v000 |
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Model |
Model Title |
Test Result |
EDIP_BOP_Bazant_Kaxiras_Si__MO_958932894036_001 |
Original EDIP potential for elemental silicon. |
view |
Four_Body_Mistriotis_Flytzanis_Farantos_Si__MO_080526771943_000 |
A four-body Mistriotis-Flytzanis-Farantos Model for Silicon |
view |
LennardJones612_UniversalShifted__MO_959249795837_002 |
Efficient "universal" shifted Lennard-Jones model for all KIM API supported species |
view |
Tersoff_LAMMPS_Erhart_Albe_CSi__MO_903987585848_001 |
Tersoff-style three-body potential for SiC by Erhart/Albe |
view |
Tersoff_LAMMPS_Erhart_Albe_CSi__MO_903987585848_002 |
Tersoff-style three-body potential for SiC by Erhart/Albe |
view |
Tersoff_LAMMPS_Erhart_Albe_SiII_CSi__MO_408791041969_000 |
Tersoff-style three-body potential for SiC by Erhart/Albe, parameter set Si II |
view |
Tersoff_LAMMPS_Erhart_Albe_SiII_CSi__MO_408791041969_001 |
Tersoff-style three-body potential for SiC by Erhart/Albe, parameter set Si II |
view |
Tersoff_LAMMPS_Tersoff_PRB37_1988_Si__MO_245095684871_000 |
Tersoff's silicon potential (PRB 37, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB37_1988_Si__MO_245095684871_001 |
Tersoff's silicon potential (PRB 37, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB38_1988_Si__MO_186459956893_000 |
Tersoff's silicon potential (PRB 38, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB38_1988_Si__MO_186459956893_001 |
Tersoff's silicon potential (PRB 38, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_CSi__MO_171585019474_000 |
Tersoff's silicon carbide potential (PRB 39, 1989) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_CSi__MO_171585019474_001 |
Tersoff's silicon carbide potential (PRB 39, 1989) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_GeSi__MO_350526375143_000 |
Tersoff's silicon germanium potential (PRB 39, 1989) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_GeSi__MO_350526375143_001 |
Tersoff's silicon germanium potential (PRB 39, 1989) |
view |
Three_Body_Stillinger_Weber_Balamane_Hauch_Brittle_Si__MO_381114941873_000 |
Three Body Stillinger Weber Combined Balamane and Hauch Brittle Silicon |
view |
Three_Body_Stillinger_Weber_Balamane_Hauch_Brittle_Si__MO_381114941873_001 |
Three Body Stillinger Weber Combined Balamane and Hauch Brittle Silicon |
view |
Three_Body_Stillinger_Weber_Balamane_Si__MO_113686039439_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Balamane et al |
view |
Three_Body_Stillinger_Weber_Balamane_Si__MO_113686039439_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Balamane et al |
view |
Three_Body_Stillinger_Weber_Hauch_Brittle_Si__MO_119167353542_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Hauch et al |
view |
Three_Body_Stillinger_Weber_Hauch_Brittle_Si__MO_119167353542_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Hauch et al |
view |
Three_Body_Stillinger_Weber_Si__MO_405512056662_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon |
view |
Three_Body_Stillinger_Weber_Si__MO_405512056662_004 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model1_Si__MO_800412945727_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model1_Si__MO_800412945727_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model2_Si__MO_475612090600_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model2_Si__MO_475612090600_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Model |
Model Title |
Test Result |
EDIP_JustoBazantKaxiras_1998_Si__MO_958932894036_002 |
EDIP model for Si developed by Justo et al. (1998) v002 |
view |
EDIP_LAMMPS_JiangMorganSzlufarska_2012_SiC__MO_667792548433_000 |
EDIP model for SiC developed by Jiang, Morgan, and Szlufarska (2012) v000 |
view |
EDIP_LAMMPS_JustoBazantKaxiras_1998_Si__MO_315965276297_000 |
EDIP model for Si developed by Justo et al. (1998) v000 |
view |
EDIP_LAMMPS_LucasBertolusPizzagalli_2009_SiC__MO_634310164305_000 |
EDIP potential for Si-C developed by Lucas, Bertolus, and Pizzagalli (2009) v000 |
view |
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003 |
Efficient 'universal' shifted Lennard-Jones model for all KIM API supported species developed by Elliott and Akerson (2015) v003 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_000 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v000 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_001 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v001 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_002 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v002 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_000 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v000 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_001 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v001 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_002 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v002 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_000 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v000 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_001 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v001 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_002 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v002 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_000 |
MEAM potential for Si developed by Huang et al. (2018) v000 |
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MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_001 |
MEAM potential for Si developed by Huang et al. (2018) v001 |
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MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_002 |
MEAM potential for Si developed by Huang et al. (2018) v002 |
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MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_000 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v000 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_001 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v001 |
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MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_002 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v002 |
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MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_000 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v000 |
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MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_001 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v001 |
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MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_002 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v002 |
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MEAM_LAMMPS_Lee_2007_Si__MO_774917820956_000 |
MEAM Potential for Si developed by Lee (2007) v000 |
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MEAM_LAMMPS_Lee_2007_Si__MO_774917820956_001 |
MEAM Potential for Si developed by Lee (2007) v001 |
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MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_000 |
MEAM potential for Si system developed by Lenosky et al. (2000) v000 |
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MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_001 |
MEAM potential for Si system developed by Lenosky et al. (2000) v001 |
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MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_002 |
MEAM potential for Si system developed by Lenosky et al. (2000) v002 |
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MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_000 |
MEAM potential for Si-C developed by Wagner (2007) v000 |
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MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_001 |
MEAM potential for Si-C developed by Wagner (2007) v001 |
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MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_002 |
MEAM potential for Si-C developed by Wagner (2007) v002 |
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MFF_MistriotisFlytzanisFarantos_1989_Si__MO_080526771943_001 |
MFF potential for Si developed by Mistriotis, Flytzanis and Farantos (1989) v001 |
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Sim_LAMMPS_ADP_StarikovGordeevLysogorskiy_2020_SiAuAl__SM_113843830602_000 |
LAMMPS ADP potential for the Si-Au-Al system developed by Starikov et al. (2020) v000 |
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Sim_LAMMPS_ADP_StarikovLopanitsynaSmirnova_2018_SiAu__SM_985135773293_000 |
LAMMPS ADP potential for the Si-Au system developed by Starikov et al. (2018) v000 |
view |
Sim_LAMMPS_EDIP_LucasBertolusPizzagalli_2009_SiC__SM_435704953434_000 |
LAMMPS EDIP potential for Si-C developed by Lucas, Bertolus, and Pizzagalli (2009) v000 |
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Sim_LAMMPS_GW_GaoWeber_2002_SiC__SM_606253546840_000 |
LAMMPS Gao-Weber potential for Si-C developed by Gao and Weber (2002) v000 |
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Sim_LAMMPS_GWZBL_Samolyuk_2016_SiC__SM_720598599889_000 |
LAMMPS Gao-Weber potential combined with a modified repulsive ZBL core function for the Si-C system developed by German Samolyuk (2016) v000 |
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Sim_LAMMPS_MEAM_CuiGaoCui_2012_LiSi__SM_562938628131_000 |
LAMMPS MEAM potential for Li-Si alloys developed by Cui et al. (2012) v000 |
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Sim_LAMMPS_MEAM_DuLenoskyHennig_2011_Si__SM_662785656123_000 |
LAMMPS Spline-based MEAM potential for Si system developed by Du et al. (2011) v000 |
view |
Sim_LAMMPS_MEAM_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__SM_656517352485_000 |
LAMMPS MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v000 |
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Sim_LAMMPS_MEAM_LenoskySadighAlonso_2000_Si__SM_622320990752_000 |
LAMMPS MEAM potential for Si system developed by Lenosky et al. (2000) v000 |
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Sim_LAMMPS_MEAM_Wagner_2007_SiC__SM_264944083668_000 |
LAMMPS MEAM potential for Si-C developed by Wagner (2007) v000 |
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Sim_LAMMPS_ModifiedTersoff_KumagaiIzumiHara_2007_Si__SM_773333226968_000 |
LAMMPS Modified Tersoff potential for Si by Kumagai et al. (2007) v000 |
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Sim_LAMMPS_ModifiedTersoff_PurjaPunMishin_2017_Si__SM_184524061456_000 |
LAMMPS Modified Tersoff potential for Si developed by Purja Pun and Mishin (2017) v000 |
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Sim_LAMMPS_ReaxFF_BrugnoliMiyataniAkaji_SiCeNaClHO_2023__SM_282799919035_000 |
LAMMPS ReaxFF potential for Ceria/Silica/Water/NaCl developed by Brugnoli et al. (2023) v000 |
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Sim_LAMMPS_ReaxFF_ManzanoMoeiniMarinelli_2012_CaSiOH__SM_714124634215_000 |
LAMMPS ReaxFF potential for Ca-Si-O-H systems developed by Manzano et al. (2012) v000 |
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Sim_LAMMPS_TersoffZBL_DevanathanDiazdelaRubiaWeber_1998_SiC__SM_578912636995_000 |
LAMMPS Tersoff-ZBL potential for Si-C developed by Devanathan, Diaz de la Rubia, and Weber (1998) v000 |
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Sim_LAMMPS_Vashishta_BroughtonMeliVashishta_1997_SiO__SM_422553794879_000 |
LAMMPS Vashishta potential for the Si-O system developed by Broughton et al. (1997) v000 |
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Sim_LAMMPS_Vashishta_NakanoKaliaVashishta_1994_SiO__SM_503555646986_000 |
LAMMPS Vashishta potential for the Si-O system developed by Nakano et al. (1994) v000 |
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Sim_LAMMPS_Vashishta_VashishtaKaliaNakano_2007_SiC__SM_196548226654_000 |
LAMMPS Vashishta potential for the Si-C system developed by Vashishta et al. (2007) v000 |
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Sim_LAMMPS_Vashishta_VashishtaKaliaRino_1990_SiO__SM_887826436433_000 |
LAMMPS Vashishta potential for the Si-O system developed by Vashishta et al. (1990) v000 |
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SNAP_ZuoChenLi_2019_Si__MO_869330304805_000 |
A spectral neighbor analysis potential for Si developed by Yunxing Zuo v000 |
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SNAP_ZuoChenLi_2019quadratic_Si__MO_721469752060_000 |
A quadratic spectral neighbor analysis potential for Si developed by Yunxing Zuo v000 |
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SW_BalamaneHaliciogluTiller_1992_Si__MO_113686039439_004 |
Stillinger-Weber potential for Si developed by Balamane, Halicioglu and Tiller (1992) v004 |
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SW_BalamaneHaliciogluTiller_1992_Si__MO_113686039439_005 |
Stillinger-Weber potential for Si developed by Balamane, Halicioglu and Tiller (1992) v005 |
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SW_BalamaneHauchShi_2017Brittle_Si__MO_381114941873_002 |
Stillinger-Weber potential for brittle Si combining the modifications of Balamane et al. (1992) and Hauch et al. (1999) v002 |
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SW_BalamaneHauchShi_2017Brittle_Si__MO_381114941873_003 |
Stillinger-Weber potential for brittle Si combining the modifications of Balamane et al. (1992) and Hauch et al. (1999) v003 |
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SW_HauchHollandMarder_1999Brittle_Si__MO_119167353542_004 |
Stillinger-Weber potential for brittle Si due to Hauch et al. (1999) v004 |
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SW_HauchHollandMarder_1999Brittle_Si__MO_119167353542_005 |
Stillinger-Weber potential for brittle Si due to Hauch et al. (1999) v005 |
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SW_LeeHwang_2012GGA_Si__MO_040570764911_000 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); GGA parameterization v000 |
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SW_LeeHwang_2012GGA_Si__MO_040570764911_001 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); GGA parameterization v001 |
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SW_LeeHwang_2012LDA_Si__MO_517338295712_000 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); LDA parameterization v000 |
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SW_LeeHwang_2012LDA_Si__MO_517338295712_001 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); LDA parameterization v001 |
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SW_StillingerWeber_1985_Si__MO_405512056662_005 |
Stillinger-Weber potential for Si due to Stillinger and Weber (1985) v005 |
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SW_StillingerWeber_1985_Si__MO_405512056662_006 |
Stillinger-Weber potential for Si due to Stillinger and Weber (1985) v006 |
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SW_ZhangXieHu_2014OptimizedSW1_Si__MO_800412945727_004 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW1' v004 |
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SW_ZhangXieHu_2014OptimizedSW1_Si__MO_800412945727_005 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW1' v005 |
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SW_ZhangXieHu_2014OptimizedSW2_Si__MO_475612090600_004 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW2' v004 |
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SW_ZhangXieHu_2014OptimizedSW2_Si__MO_475612090600_005 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW2' v005 |
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Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_003 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v003 |
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Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_004 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v004 |
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Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_005 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v005 |
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Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_002 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v002 |
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Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_003 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v003 |
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Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_004 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v004 |
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Tersoff_LAMMPS_MunetohMotookaMoriguchi_2007_SiO__MO_501246546792_000 |
Tersoff-style three-body potential for SiO developed by Munetoh et al. (2007) v000 |
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Tersoff_LAMMPS_PlummerTucker_2019_TiSiC__MO_751442731010_000 |
Tersoff-style three-body potential for TiSiC developed by Plummer and Tucker (2019) v000 |
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Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_002 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v002 |
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Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_003 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v003 |
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Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_004 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v004 |
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Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_002 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v002 |
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Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_003 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v003 |
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Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_004 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v004 |
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Tersoff_LAMMPS_Tersoff_1989_SiC__MO_171585019474_002 |
Tersoff-style three-body potential for SiC developed by Tersoff (1989) v002 |
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Tersoff_LAMMPS_Tersoff_1989_SiC__MO_171585019474_003 |
Tersoff-style three-body potential for SiC developed by Tersoff (1989) v003 |
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Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_002 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v002 |
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Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_003 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v003 |
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Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_004 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v004 |
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Tersoff_LAMMPS_Tersoff_1990_SiC__MO_444207127575_000 |
Tersoff-style three-body potential for SiC developed by Tersoff (1990) v000 |
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Tersoff_LAMMPS_Tersoff_1994_SiC__MO_794973922560_000 |
Tersoff-style three-body potential for SiC developed by Tersoff (1994) v000 |
view |
ThreeBodyBondOrder_KDS_KhorDasSarma_1988_Si__MO_722489435928_000 |
Three-body cluster potential for Si by Khor and Das Sarma (1988) v000 |
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ThreeBodyBondOrder_PPM_PurjaPunMishin_2017_Si__MO_566683736730_000 |
Three-body bond-order potential for Si by Purja Pun and Mishin (2017) v000 |
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ThreeBodyBondOrder_WR_WangRockett_1991_Si__MO_081872846741_000 |
Three-body bond-order potential for Si by Wang and Rockett (1991) v000 |
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ThreeBodyCluster_BH_BiswasHamann_1987_Si__MO_019616213550_000 |
Three-body cluster potential for Si by Biswas and Hamann (1987) v000 |
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ThreeBodyCluster_Gong_Gong_1993_Si__MO_407755720412_000 |
Three-body cluster potential for Si by Gong (1993) v000 |
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ThreeBodyCluster_KP_KaxirasPandey_1988_Si__MO_072486242437_000 |
Three-body cluster potential for Si by Kaxiras and Pandey (1988) v000 |
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ThreeBodyCluster_SRS_StephensonRadnySmith_1996_Si__MO_604248666067_000 |
Three-body cluster potential for Si by Stephenson, Radny and Smith (1996) v000 |
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TorchML_MACE_GuptaTadmorMartiniani_2024_Si__MO_781946209112_000 |
Parallel MACE Equivariant GNN for Si developed by Gupta et al. (2024) v000 |
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TorchML_NequIP_GuptaTadmorMartiniani_2024_Si__MO_196181738937_000 |
Parallel NequIP Equivariant GNN for Si developed by Gupta et al. (2024) v000 |
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Model |
Model Title |
Test Result |
EDIP_BOP_Bazant_Kaxiras_Si__MO_958932894036_001 |
Original EDIP potential for elemental silicon. |
view |
Four_Body_Mistriotis_Flytzanis_Farantos_Si__MO_080526771943_000 |
A four-body Mistriotis-Flytzanis-Farantos Model for Silicon |
view |
LennardJones612_UniversalShifted__MO_959249795837_002 |
Efficient "universal" shifted Lennard-Jones model for all KIM API supported species |
view |
Tersoff_LAMMPS_Erhart_Albe_CSi__MO_903987585848_001 |
Tersoff-style three-body potential for SiC by Erhart/Albe |
view |
Tersoff_LAMMPS_Erhart_Albe_CSi__MO_903987585848_002 |
Tersoff-style three-body potential for SiC by Erhart/Albe |
view |
Tersoff_LAMMPS_Erhart_Albe_SiII_CSi__MO_408791041969_000 |
Tersoff-style three-body potential for SiC by Erhart/Albe, parameter set Si II |
view |
Tersoff_LAMMPS_Erhart_Albe_SiII_CSi__MO_408791041969_001 |
Tersoff-style three-body potential for SiC by Erhart/Albe, parameter set Si II |
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Tersoff_LAMMPS_Tersoff_PRB37_1988_Si__MO_245095684871_000 |
Tersoff's silicon potential (PRB 37, 1988) |
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Tersoff_LAMMPS_Tersoff_PRB37_1988_Si__MO_245095684871_001 |
Tersoff's silicon potential (PRB 37, 1988) |
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Tersoff_LAMMPS_Tersoff_PRB38_1988_Si__MO_186459956893_000 |
Tersoff's silicon potential (PRB 38, 1988) |
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Tersoff_LAMMPS_Tersoff_PRB38_1988_Si__MO_186459956893_001 |
Tersoff's silicon potential (PRB 38, 1988) |
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Tersoff_LAMMPS_Tersoff_PRB39_1989_CSi__MO_171585019474_000 |
Tersoff's silicon carbide potential (PRB 39, 1989) |
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Tersoff_LAMMPS_Tersoff_PRB39_1989_CSi__MO_171585019474_001 |
Tersoff's silicon carbide potential (PRB 39, 1989) |
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Tersoff_LAMMPS_Tersoff_PRB39_1989_GeSi__MO_350526375143_000 |
Tersoff's silicon germanium potential (PRB 39, 1989) |
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Tersoff_LAMMPS_Tersoff_PRB39_1989_GeSi__MO_350526375143_001 |
Tersoff's silicon germanium potential (PRB 39, 1989) |
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Three_Body_Stillinger_Weber_Balamane_Hauch_Brittle_Si__MO_381114941873_000 |
Three Body Stillinger Weber Combined Balamane and Hauch Brittle Silicon |
view |
Three_Body_Stillinger_Weber_Balamane_Hauch_Brittle_Si__MO_381114941873_001 |
Three Body Stillinger Weber Combined Balamane and Hauch Brittle Silicon |
view |
Three_Body_Stillinger_Weber_Balamane_Si__MO_113686039439_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Balamane et al |
view |
Three_Body_Stillinger_Weber_Balamane_Si__MO_113686039439_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Balamane et al |
view |
Three_Body_Stillinger_Weber_Hauch_Brittle_Si__MO_119167353542_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Hauch et al |
view |
Three_Body_Stillinger_Weber_Hauch_Brittle_Si__MO_119167353542_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Hauch et al |
view |
Three_Body_Stillinger_Weber_Si__MO_405512056662_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon |
view |
Three_Body_Stillinger_Weber_Si__MO_405512056662_004 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model1_Si__MO_800412945727_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model1_Si__MO_800412945727_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model2_Si__MO_475612090600_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model2_Si__MO_475612090600_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Model |
Model Title |
Test Result |
EDIP_JustoBazantKaxiras_1998_Si__MO_958932894036_002 |
EDIP model for Si developed by Justo et al. (1998) v002 |
view |
EDIP_LAMMPS_JiangMorganSzlufarska_2012_SiC__MO_667792548433_000 |
EDIP model for SiC developed by Jiang, Morgan, and Szlufarska (2012) v000 |
view |
EDIP_LAMMPS_JustoBazantKaxiras_1998_Si__MO_315965276297_000 |
EDIP model for Si developed by Justo et al. (1998) v000 |
view |
EDIP_LAMMPS_LucasBertolusPizzagalli_2009_SiC__MO_634310164305_000 |
EDIP potential for Si-C developed by Lucas, Bertolus, and Pizzagalli (2009) v000 |
view |
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003 |
Efficient 'universal' shifted Lennard-Jones model for all KIM API supported species developed by Elliott and Akerson (2015) v003 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_000 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v000 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_001 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v001 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_002 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v002 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_000 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v000 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_001 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v001 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_002 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v002 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_000 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v000 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_001 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v001 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_002 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v002 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_000 |
MEAM potential for Si developed by Huang et al. (2018) v000 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_001 |
MEAM potential for Si developed by Huang et al. (2018) v001 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_002 |
MEAM potential for Si developed by Huang et al. (2018) v002 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_000 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v000 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_001 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v001 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_002 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v002 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_000 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v000 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_001 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v001 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_002 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v002 |
view |
MEAM_LAMMPS_Lee_2007_Si__MO_774917820956_000 |
MEAM Potential for Si developed by Lee (2007) v000 |
view |
MEAM_LAMMPS_Lee_2007_Si__MO_774917820956_001 |
MEAM Potential for Si developed by Lee (2007) v001 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_000 |
MEAM potential for Si system developed by Lenosky et al. (2000) v000 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_001 |
MEAM potential for Si system developed by Lenosky et al. (2000) v001 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_002 |
MEAM potential for Si system developed by Lenosky et al. (2000) v002 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_000 |
MEAM potential for Si-C developed by Wagner (2007) v000 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_001 |
MEAM potential for Si-C developed by Wagner (2007) v001 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_002 |
MEAM potential for Si-C developed by Wagner (2007) v002 |
view |
MFF_MistriotisFlytzanisFarantos_1989_Si__MO_080526771943_001 |
MFF potential for Si developed by Mistriotis, Flytzanis and Farantos (1989) v001 |
view |
Sim_LAMMPS_ADP_StarikovGordeevLysogorskiy_2020_SiAuAl__SM_113843830602_000 |
LAMMPS ADP potential for the Si-Au-Al system developed by Starikov et al. (2020) v000 |
view |
Sim_LAMMPS_ADP_StarikovLopanitsynaSmirnova_2018_SiAu__SM_985135773293_000 |
LAMMPS ADP potential for the Si-Au system developed by Starikov et al. (2018) v000 |
view |
Sim_LAMMPS_EDIP_LucasBertolusPizzagalli_2009_SiC__SM_435704953434_000 |
LAMMPS EDIP potential for Si-C developed by Lucas, Bertolus, and Pizzagalli (2009) v000 |
view |
Sim_LAMMPS_GW_GaoWeber_2002_SiC__SM_606253546840_000 |
LAMMPS Gao-Weber potential for Si-C developed by Gao and Weber (2002) v000 |
view |
Sim_LAMMPS_GWZBL_Samolyuk_2016_SiC__SM_720598599889_000 |
LAMMPS Gao-Weber potential combined with a modified repulsive ZBL core function for the Si-C system developed by German Samolyuk (2016) v000 |
view |
Sim_LAMMPS_MEAM_CuiGaoCui_2012_LiSi__SM_562938628131_000 |
LAMMPS MEAM potential for Li-Si alloys developed by Cui et al. (2012) v000 |
view |
Sim_LAMMPS_MEAM_DuLenoskyHennig_2011_Si__SM_662785656123_000 |
LAMMPS Spline-based MEAM potential for Si system developed by Du et al. (2011) v000 |
view |
Sim_LAMMPS_MEAM_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__SM_656517352485_000 |
LAMMPS MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v000 |
view |
Sim_LAMMPS_MEAM_LenoskySadighAlonso_2000_Si__SM_622320990752_000 |
LAMMPS MEAM potential for Si system developed by Lenosky et al. (2000) v000 |
view |
Sim_LAMMPS_MEAM_Wagner_2007_SiC__SM_264944083668_000 |
LAMMPS MEAM potential for Si-C developed by Wagner (2007) v000 |
view |
Sim_LAMMPS_ModifiedTersoff_KumagaiIzumiHara_2007_Si__SM_773333226968_000 |
LAMMPS Modified Tersoff potential for Si by Kumagai et al. (2007) v000 |
view |
Sim_LAMMPS_ModifiedTersoff_PurjaPunMishin_2017_Si__SM_184524061456_000 |
LAMMPS Modified Tersoff potential for Si developed by Purja Pun and Mishin (2017) v000 |
view |
Sim_LAMMPS_ReaxFF_BrugnoliMiyataniAkaji_SiCeNaClHO_2023__SM_282799919035_000 |
LAMMPS ReaxFF potential for Ceria/Silica/Water/NaCl developed by Brugnoli et al. (2023) v000 |
view |
Sim_LAMMPS_ReaxFF_ManzanoMoeiniMarinelli_2012_CaSiOH__SM_714124634215_000 |
LAMMPS ReaxFF potential for Ca-Si-O-H systems developed by Manzano et al. (2012) v000 |
view |
Sim_LAMMPS_TersoffZBL_DevanathanDiazdelaRubiaWeber_1998_SiC__SM_578912636995_000 |
LAMMPS Tersoff-ZBL potential for Si-C developed by Devanathan, Diaz de la Rubia, and Weber (1998) v000 |
view |
Sim_LAMMPS_Vashishta_BroughtonMeliVashishta_1997_SiO__SM_422553794879_000 |
LAMMPS Vashishta potential for the Si-O system developed by Broughton et al. (1997) v000 |
view |
Sim_LAMMPS_Vashishta_NakanoKaliaVashishta_1994_SiO__SM_503555646986_000 |
LAMMPS Vashishta potential for the Si-O system developed by Nakano et al. (1994) v000 |
view |
Sim_LAMMPS_Vashishta_VashishtaKaliaNakano_2007_SiC__SM_196548226654_000 |
LAMMPS Vashishta potential for the Si-C system developed by Vashishta et al. (2007) v000 |
view |
Sim_LAMMPS_Vashishta_VashishtaKaliaRino_1990_SiO__SM_887826436433_000 |
LAMMPS Vashishta potential for the Si-O system developed by Vashishta et al. (1990) v000 |
view |
SNAP_ZuoChenLi_2019_Si__MO_869330304805_000 |
A spectral neighbor analysis potential for Si developed by Yunxing Zuo v000 |
view |
SNAP_ZuoChenLi_2019quadratic_Si__MO_721469752060_000 |
A quadratic spectral neighbor analysis potential for Si developed by Yunxing Zuo v000 |
view |
SW_BalamaneHaliciogluTiller_1992_Si__MO_113686039439_004 |
Stillinger-Weber potential for Si developed by Balamane, Halicioglu and Tiller (1992) v004 |
view |
SW_BalamaneHaliciogluTiller_1992_Si__MO_113686039439_005 |
Stillinger-Weber potential for Si developed by Balamane, Halicioglu and Tiller (1992) v005 |
view |
SW_BalamaneHauchShi_2017Brittle_Si__MO_381114941873_002 |
Stillinger-Weber potential for brittle Si combining the modifications of Balamane et al. (1992) and Hauch et al. (1999) v002 |
view |
SW_BalamaneHauchShi_2017Brittle_Si__MO_381114941873_003 |
Stillinger-Weber potential for brittle Si combining the modifications of Balamane et al. (1992) and Hauch et al. (1999) v003 |
view |
SW_HauchHollandMarder_1999Brittle_Si__MO_119167353542_004 |
Stillinger-Weber potential for brittle Si due to Hauch et al. (1999) v004 |
view |
SW_HauchHollandMarder_1999Brittle_Si__MO_119167353542_005 |
Stillinger-Weber potential for brittle Si due to Hauch et al. (1999) v005 |
view |
SW_LeeHwang_2012GGA_Si__MO_040570764911_000 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); GGA parameterization v000 |
view |
SW_LeeHwang_2012GGA_Si__MO_040570764911_001 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); GGA parameterization v001 |
view |
SW_LeeHwang_2012LDA_Si__MO_517338295712_000 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); LDA parameterization v000 |
view |
SW_LeeHwang_2012LDA_Si__MO_517338295712_001 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); LDA parameterization v001 |
view |
SW_StillingerWeber_1985_Si__MO_405512056662_005 |
Stillinger-Weber potential for Si due to Stillinger and Weber (1985) v005 |
view |
SW_StillingerWeber_1985_Si__MO_405512056662_006 |
Stillinger-Weber potential for Si due to Stillinger and Weber (1985) v006 |
view |
SW_ZhangXieHu_2014OptimizedSW1_Si__MO_800412945727_004 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW1' v004 |
view |
SW_ZhangXieHu_2014OptimizedSW1_Si__MO_800412945727_005 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW1' v005 |
view |
SW_ZhangXieHu_2014OptimizedSW2_Si__MO_475612090600_004 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW2' v004 |
view |
SW_ZhangXieHu_2014OptimizedSW2_Si__MO_475612090600_005 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW2' v005 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_003 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v003 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_004 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v004 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_005 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v005 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_002 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v002 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_003 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v003 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_004 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v004 |
view |
Tersoff_LAMMPS_MunetohMotookaMoriguchi_2007_SiO__MO_501246546792_000 |
Tersoff-style three-body potential for SiO developed by Munetoh et al. (2007) v000 |
view |
Tersoff_LAMMPS_PlummerTucker_2019_TiSiC__MO_751442731010_000 |
Tersoff-style three-body potential for TiSiC developed by Plummer and Tucker (2019) v000 |
view |
Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_002 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v002 |
view |
Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_003 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v003 |
view |
Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_004 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v004 |
view |
Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_002 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v002 |
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Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_003 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v003 |
view |
Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_004 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v004 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiC__MO_171585019474_002 |
Tersoff-style three-body potential for SiC developed by Tersoff (1989) v002 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiC__MO_171585019474_003 |
Tersoff-style three-body potential for SiC developed by Tersoff (1989) v003 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_002 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v002 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_003 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v003 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_004 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v004 |
view |
Tersoff_LAMMPS_Tersoff_1990_SiC__MO_444207127575_000 |
Tersoff-style three-body potential for SiC developed by Tersoff (1990) v000 |
view |
Tersoff_LAMMPS_Tersoff_1994_SiC__MO_794973922560_000 |
Tersoff-style three-body potential for SiC developed by Tersoff (1994) v000 |
view |
ThreeBodyBondOrder_KDS_KhorDasSarma_1988_Si__MO_722489435928_000 |
Three-body cluster potential for Si by Khor and Das Sarma (1988) v000 |
view |
ThreeBodyBondOrder_PPM_PurjaPunMishin_2017_Si__MO_566683736730_000 |
Three-body bond-order potential for Si by Purja Pun and Mishin (2017) v000 |
view |
ThreeBodyBondOrder_WR_WangRockett_1991_Si__MO_081872846741_000 |
Three-body bond-order potential for Si by Wang and Rockett (1991) v000 |
view |
ThreeBodyCluster_BH_BiswasHamann_1987_Si__MO_019616213550_000 |
Three-body cluster potential for Si by Biswas and Hamann (1987) v000 |
view |
ThreeBodyCluster_Gong_Gong_1993_Si__MO_407755720412_000 |
Three-body cluster potential for Si by Gong (1993) v000 |
view |
ThreeBodyCluster_KP_KaxirasPandey_1988_Si__MO_072486242437_000 |
Three-body cluster potential for Si by Kaxiras and Pandey (1988) v000 |
view |
ThreeBodyCluster_SRS_StephensonRadnySmith_1996_Si__MO_604248666067_000 |
Three-body cluster potential for Si by Stephenson, Radny and Smith (1996) v000 |
view |
TorchML_MACE_GuptaTadmorMartiniani_2024_Si__MO_781946209112_000 |
Parallel MACE Equivariant GNN for Si developed by Gupta et al. (2024) v000 |
view |
TorchML_NequIP_GuptaTadmorMartiniani_2024_Si__MO_196181738937_000 |
Parallel NequIP Equivariant GNN for Si developed by Gupta et al. (2024) v000 |
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Model |
Model Title |
Test Result |
EDIP_BOP_Bazant_Kaxiras_Si__MO_958932894036_001 |
Original EDIP potential for elemental silicon. |
view |
Four_Body_Mistriotis_Flytzanis_Farantos_Si__MO_080526771943_000 |
A four-body Mistriotis-Flytzanis-Farantos Model for Silicon |
view |
LennardJones612_UniversalShifted__MO_959249795837_002 |
Efficient "universal" shifted Lennard-Jones model for all KIM API supported species |
view |
Tersoff_LAMMPS_Erhart_Albe_CSi__MO_903987585848_001 |
Tersoff-style three-body potential for SiC by Erhart/Albe |
view |
Tersoff_LAMMPS_Erhart_Albe_CSi__MO_903987585848_002 |
Tersoff-style three-body potential for SiC by Erhart/Albe |
view |
Tersoff_LAMMPS_Erhart_Albe_SiII_CSi__MO_408791041969_000 |
Tersoff-style three-body potential for SiC by Erhart/Albe, parameter set Si II |
view |
Tersoff_LAMMPS_Erhart_Albe_SiII_CSi__MO_408791041969_001 |
Tersoff-style three-body potential for SiC by Erhart/Albe, parameter set Si II |
view |
Tersoff_LAMMPS_Tersoff_PRB37_1988_Si__MO_245095684871_000 |
Tersoff's silicon potential (PRB 37, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB37_1988_Si__MO_245095684871_001 |
Tersoff's silicon potential (PRB 37, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB38_1988_Si__MO_186459956893_000 |
Tersoff's silicon potential (PRB 38, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB38_1988_Si__MO_186459956893_001 |
Tersoff's silicon potential (PRB 38, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_CSi__MO_171585019474_000 |
Tersoff's silicon carbide potential (PRB 39, 1989) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_CSi__MO_171585019474_001 |
Tersoff's silicon carbide potential (PRB 39, 1989) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_GeSi__MO_350526375143_000 |
Tersoff's silicon germanium potential (PRB 39, 1989) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_GeSi__MO_350526375143_001 |
Tersoff's silicon germanium potential (PRB 39, 1989) |
view |
Three_Body_Stillinger_Weber_Balamane_Hauch_Brittle_Si__MO_381114941873_000 |
Three Body Stillinger Weber Combined Balamane and Hauch Brittle Silicon |
view |
Three_Body_Stillinger_Weber_Balamane_Hauch_Brittle_Si__MO_381114941873_001 |
Three Body Stillinger Weber Combined Balamane and Hauch Brittle Silicon |
view |
Three_Body_Stillinger_Weber_Balamane_Si__MO_113686039439_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Balamane et al |
view |
Three_Body_Stillinger_Weber_Balamane_Si__MO_113686039439_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Balamane et al |
view |
Three_Body_Stillinger_Weber_Hauch_Brittle_Si__MO_119167353542_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Hauch et al |
view |
Three_Body_Stillinger_Weber_Hauch_Brittle_Si__MO_119167353542_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Hauch et al |
view |
Three_Body_Stillinger_Weber_Si__MO_405512056662_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon |
view |
Three_Body_Stillinger_Weber_Si__MO_405512056662_004 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model1_Si__MO_800412945727_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model1_Si__MO_800412945727_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model2_Si__MO_475612090600_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model2_Si__MO_475612090600_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Model |
Model Title |
Test Result |
EDIP_JustoBazantKaxiras_1998_Si__MO_958932894036_002 |
EDIP model for Si developed by Justo et al. (1998) v002 |
view |
EDIP_LAMMPS_JiangMorganSzlufarska_2012_SiC__MO_667792548433_000 |
EDIP model for SiC developed by Jiang, Morgan, and Szlufarska (2012) v000 |
view |
EDIP_LAMMPS_JustoBazantKaxiras_1998_Si__MO_315965276297_000 |
EDIP model for Si developed by Justo et al. (1998) v000 |
view |
EDIP_LAMMPS_LucasBertolusPizzagalli_2009_SiC__MO_634310164305_000 |
EDIP potential for Si-C developed by Lucas, Bertolus, and Pizzagalli (2009) v000 |
view |
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003 |
Efficient 'universal' shifted Lennard-Jones model for all KIM API supported species developed by Elliott and Akerson (2015) v003 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_000 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v000 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_001 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v001 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_002 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v002 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_000 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v000 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_001 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v001 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_002 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v002 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_000 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v000 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_001 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v001 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_002 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v002 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_000 |
MEAM potential for Si developed by Huang et al. (2018) v000 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_001 |
MEAM potential for Si developed by Huang et al. (2018) v001 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_002 |
MEAM potential for Si developed by Huang et al. (2018) v002 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_000 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v000 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_001 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v001 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_002 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v002 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_000 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v000 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_001 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v001 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_002 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v002 |
view |
MEAM_LAMMPS_Lee_2007_Si__MO_774917820956_000 |
MEAM Potential for Si developed by Lee (2007) v000 |
view |
MEAM_LAMMPS_Lee_2007_Si__MO_774917820956_001 |
MEAM Potential for Si developed by Lee (2007) v001 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_000 |
MEAM potential for Si system developed by Lenosky et al. (2000) v000 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_001 |
MEAM potential for Si system developed by Lenosky et al. (2000) v001 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_002 |
MEAM potential for Si system developed by Lenosky et al. (2000) v002 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_000 |
MEAM potential for Si-C developed by Wagner (2007) v000 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_001 |
MEAM potential for Si-C developed by Wagner (2007) v001 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_002 |
MEAM potential for Si-C developed by Wagner (2007) v002 |
view |
MFF_MistriotisFlytzanisFarantos_1989_Si__MO_080526771943_001 |
MFF potential for Si developed by Mistriotis, Flytzanis and Farantos (1989) v001 |
view |
Sim_LAMMPS_ADP_StarikovGordeevLysogorskiy_2020_SiAuAl__SM_113843830602_000 |
LAMMPS ADP potential for the Si-Au-Al system developed by Starikov et al. (2020) v000 |
view |
Sim_LAMMPS_ADP_StarikovLopanitsynaSmirnova_2018_SiAu__SM_985135773293_000 |
LAMMPS ADP potential for the Si-Au system developed by Starikov et al. (2018) v000 |
view |
Sim_LAMMPS_EDIP_LucasBertolusPizzagalli_2009_SiC__SM_435704953434_000 |
LAMMPS EDIP potential for Si-C developed by Lucas, Bertolus, and Pizzagalli (2009) v000 |
view |
Sim_LAMMPS_GW_GaoWeber_2002_SiC__SM_606253546840_000 |
LAMMPS Gao-Weber potential for Si-C developed by Gao and Weber (2002) v000 |
view |
Sim_LAMMPS_GWZBL_Samolyuk_2016_SiC__SM_720598599889_000 |
LAMMPS Gao-Weber potential combined with a modified repulsive ZBL core function for the Si-C system developed by German Samolyuk (2016) v000 |
view |
Sim_LAMMPS_MEAM_CuiGaoCui_2012_LiSi__SM_562938628131_000 |
LAMMPS MEAM potential for Li-Si alloys developed by Cui et al. (2012) v000 |
view |
Sim_LAMMPS_MEAM_DuLenoskyHennig_2011_Si__SM_662785656123_000 |
LAMMPS Spline-based MEAM potential for Si system developed by Du et al. (2011) v000 |
view |
Sim_LAMMPS_MEAM_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__SM_656517352485_000 |
LAMMPS MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v000 |
view |
Sim_LAMMPS_MEAM_LenoskySadighAlonso_2000_Si__SM_622320990752_000 |
LAMMPS MEAM potential for Si system developed by Lenosky et al. (2000) v000 |
view |
Sim_LAMMPS_MEAM_Wagner_2007_SiC__SM_264944083668_000 |
LAMMPS MEAM potential for Si-C developed by Wagner (2007) v000 |
view |
Sim_LAMMPS_ModifiedTersoff_KumagaiIzumiHara_2007_Si__SM_773333226968_000 |
LAMMPS Modified Tersoff potential for Si by Kumagai et al. (2007) v000 |
view |
Sim_LAMMPS_ModifiedTersoff_PurjaPunMishin_2017_Si__SM_184524061456_000 |
LAMMPS Modified Tersoff potential for Si developed by Purja Pun and Mishin (2017) v000 |
view |
Sim_LAMMPS_ReaxFF_BrugnoliMiyataniAkaji_SiCeNaClHO_2023__SM_282799919035_000 |
LAMMPS ReaxFF potential for Ceria/Silica/Water/NaCl developed by Brugnoli et al. (2023) v000 |
view |
Sim_LAMMPS_ReaxFF_ManzanoMoeiniMarinelli_2012_CaSiOH__SM_714124634215_000 |
LAMMPS ReaxFF potential for Ca-Si-O-H systems developed by Manzano et al. (2012) v000 |
view |
Sim_LAMMPS_TersoffZBL_DevanathanDiazdelaRubiaWeber_1998_SiC__SM_578912636995_000 |
LAMMPS Tersoff-ZBL potential for Si-C developed by Devanathan, Diaz de la Rubia, and Weber (1998) v000 |
view |
Sim_LAMMPS_Vashishta_BroughtonMeliVashishta_1997_SiO__SM_422553794879_000 |
LAMMPS Vashishta potential for the Si-O system developed by Broughton et al. (1997) v000 |
view |
Sim_LAMMPS_Vashishta_NakanoKaliaVashishta_1994_SiO__SM_503555646986_000 |
LAMMPS Vashishta potential for the Si-O system developed by Nakano et al. (1994) v000 |
view |
Sim_LAMMPS_Vashishta_VashishtaKaliaNakano_2007_SiC__SM_196548226654_000 |
LAMMPS Vashishta potential for the Si-C system developed by Vashishta et al. (2007) v000 |
view |
Sim_LAMMPS_Vashishta_VashishtaKaliaRino_1990_SiO__SM_887826436433_000 |
LAMMPS Vashishta potential for the Si-O system developed by Vashishta et al. (1990) v000 |
view |
SNAP_ZuoChenLi_2019_Si__MO_869330304805_000 |
A spectral neighbor analysis potential for Si developed by Yunxing Zuo v000 |
view |
SNAP_ZuoChenLi_2019quadratic_Si__MO_721469752060_000 |
A quadratic spectral neighbor analysis potential for Si developed by Yunxing Zuo v000 |
view |
SW_BalamaneHaliciogluTiller_1992_Si__MO_113686039439_004 |
Stillinger-Weber potential for Si developed by Balamane, Halicioglu and Tiller (1992) v004 |
view |
SW_BalamaneHaliciogluTiller_1992_Si__MO_113686039439_005 |
Stillinger-Weber potential for Si developed by Balamane, Halicioglu and Tiller (1992) v005 |
view |
SW_BalamaneHauchShi_2017Brittle_Si__MO_381114941873_002 |
Stillinger-Weber potential for brittle Si combining the modifications of Balamane et al. (1992) and Hauch et al. (1999) v002 |
view |
SW_BalamaneHauchShi_2017Brittle_Si__MO_381114941873_003 |
Stillinger-Weber potential for brittle Si combining the modifications of Balamane et al. (1992) and Hauch et al. (1999) v003 |
view |
SW_HauchHollandMarder_1999Brittle_Si__MO_119167353542_004 |
Stillinger-Weber potential for brittle Si due to Hauch et al. (1999) v004 |
view |
SW_HauchHollandMarder_1999Brittle_Si__MO_119167353542_005 |
Stillinger-Weber potential for brittle Si due to Hauch et al. (1999) v005 |
view |
SW_LeeHwang_2012GGA_Si__MO_040570764911_000 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); GGA parameterization v000 |
view |
SW_LeeHwang_2012GGA_Si__MO_040570764911_001 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); GGA parameterization v001 |
view |
SW_LeeHwang_2012LDA_Si__MO_517338295712_000 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); LDA parameterization v000 |
view |
SW_LeeHwang_2012LDA_Si__MO_517338295712_001 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); LDA parameterization v001 |
view |
SW_StillingerWeber_1985_Si__MO_405512056662_005 |
Stillinger-Weber potential for Si due to Stillinger and Weber (1985) v005 |
view |
SW_StillingerWeber_1985_Si__MO_405512056662_006 |
Stillinger-Weber potential for Si due to Stillinger and Weber (1985) v006 |
view |
SW_ZhangXieHu_2014OptimizedSW1_Si__MO_800412945727_004 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW1' v004 |
view |
SW_ZhangXieHu_2014OptimizedSW1_Si__MO_800412945727_005 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW1' v005 |
view |
SW_ZhangXieHu_2014OptimizedSW2_Si__MO_475612090600_004 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW2' v004 |
view |
SW_ZhangXieHu_2014OptimizedSW2_Si__MO_475612090600_005 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW2' v005 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_003 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v003 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_004 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v004 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_005 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v005 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_002 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v002 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_003 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v003 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_004 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v004 |
view |
Tersoff_LAMMPS_MunetohMotookaMoriguchi_2007_SiO__MO_501246546792_000 |
Tersoff-style three-body potential for SiO developed by Munetoh et al. (2007) v000 |
view |
Tersoff_LAMMPS_PlummerTucker_2019_TiSiC__MO_751442731010_000 |
Tersoff-style three-body potential for TiSiC developed by Plummer and Tucker (2019) v000 |
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Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_002 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v002 |
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Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_003 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v003 |
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Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_004 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v004 |
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Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_002 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v002 |
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Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_003 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v003 |
view |
Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_004 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v004 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiC__MO_171585019474_002 |
Tersoff-style three-body potential for SiC developed by Tersoff (1989) v002 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiC__MO_171585019474_003 |
Tersoff-style three-body potential for SiC developed by Tersoff (1989) v003 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_002 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v002 |
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Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_003 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v003 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_004 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v004 |
view |
Tersoff_LAMMPS_Tersoff_1990_SiC__MO_444207127575_000 |
Tersoff-style three-body potential for SiC developed by Tersoff (1990) v000 |
view |
Tersoff_LAMMPS_Tersoff_1994_SiC__MO_794973922560_000 |
Tersoff-style three-body potential for SiC developed by Tersoff (1994) v000 |
view |
ThreeBodyBondOrder_KDS_KhorDasSarma_1988_Si__MO_722489435928_000 |
Three-body cluster potential for Si by Khor and Das Sarma (1988) v000 |
view |
ThreeBodyBondOrder_PPM_PurjaPunMishin_2017_Si__MO_566683736730_000 |
Three-body bond-order potential for Si by Purja Pun and Mishin (2017) v000 |
view |
ThreeBodyBondOrder_WR_WangRockett_1991_Si__MO_081872846741_000 |
Three-body bond-order potential for Si by Wang and Rockett (1991) v000 |
view |
ThreeBodyCluster_BH_BiswasHamann_1987_Si__MO_019616213550_000 |
Three-body cluster potential for Si by Biswas and Hamann (1987) v000 |
view |
ThreeBodyCluster_Gong_Gong_1993_Si__MO_407755720412_000 |
Three-body cluster potential for Si by Gong (1993) v000 |
view |
ThreeBodyCluster_KP_KaxirasPandey_1988_Si__MO_072486242437_000 |
Three-body cluster potential for Si by Kaxiras and Pandey (1988) v000 |
view |
ThreeBodyCluster_SRS_StephensonRadnySmith_1996_Si__MO_604248666067_000 |
Three-body cluster potential for Si by Stephenson, Radny and Smith (1996) v000 |
view |
TorchML_MACE_GuptaTadmorMartiniani_2024_Si__MO_781946209112_000 |
Parallel MACE Equivariant GNN for Si developed by Gupta et al. (2024) v000 |
view |
TorchML_NequIP_GuptaTadmorMartiniani_2024_Si__MO_196181738937_000 |
Parallel NequIP Equivariant GNN for Si developed by Gupta et al. (2024) v000 |
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Model |
Model Title |
Test Result |
EDIP_BOP_Bazant_Kaxiras_Si__MO_958932894036_001 |
Original EDIP potential for elemental silicon. |
view |
Four_Body_Mistriotis_Flytzanis_Farantos_Si__MO_080526771943_000 |
A four-body Mistriotis-Flytzanis-Farantos Model for Silicon |
view |
LennardJones612_UniversalShifted__MO_959249795837_002 |
Efficient "universal" shifted Lennard-Jones model for all KIM API supported species |
view |
Tersoff_LAMMPS_Erhart_Albe_CSi__MO_903987585848_001 |
Tersoff-style three-body potential for SiC by Erhart/Albe |
view |
Tersoff_LAMMPS_Erhart_Albe_CSi__MO_903987585848_002 |
Tersoff-style three-body potential for SiC by Erhart/Albe |
view |
Tersoff_LAMMPS_Erhart_Albe_SiII_CSi__MO_408791041969_000 |
Tersoff-style three-body potential for SiC by Erhart/Albe, parameter set Si II |
view |
Tersoff_LAMMPS_Erhart_Albe_SiII_CSi__MO_408791041969_001 |
Tersoff-style three-body potential for SiC by Erhart/Albe, parameter set Si II |
view |
Tersoff_LAMMPS_Tersoff_PRB37_1988_Si__MO_245095684871_000 |
Tersoff's silicon potential (PRB 37, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB37_1988_Si__MO_245095684871_001 |
Tersoff's silicon potential (PRB 37, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB38_1988_Si__MO_186459956893_000 |
Tersoff's silicon potential (PRB 38, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB38_1988_Si__MO_186459956893_001 |
Tersoff's silicon potential (PRB 38, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_CSi__MO_171585019474_000 |
Tersoff's silicon carbide potential (PRB 39, 1989) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_CSi__MO_171585019474_001 |
Tersoff's silicon carbide potential (PRB 39, 1989) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_GeSi__MO_350526375143_000 |
Tersoff's silicon germanium potential (PRB 39, 1989) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_GeSi__MO_350526375143_001 |
Tersoff's silicon germanium potential (PRB 39, 1989) |
view |
Three_Body_Stillinger_Weber_Balamane_Hauch_Brittle_Si__MO_381114941873_000 |
Three Body Stillinger Weber Combined Balamane and Hauch Brittle Silicon |
view |
Three_Body_Stillinger_Weber_Balamane_Hauch_Brittle_Si__MO_381114941873_001 |
Three Body Stillinger Weber Combined Balamane and Hauch Brittle Silicon |
view |
Three_Body_Stillinger_Weber_Balamane_Si__MO_113686039439_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Balamane et al |
view |
Three_Body_Stillinger_Weber_Balamane_Si__MO_113686039439_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Balamane et al |
view |
Three_Body_Stillinger_Weber_Hauch_Brittle_Si__MO_119167353542_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Hauch et al |
view |
Three_Body_Stillinger_Weber_Hauch_Brittle_Si__MO_119167353542_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Hauch et al |
view |
Three_Body_Stillinger_Weber_Si__MO_405512056662_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon |
view |
Three_Body_Stillinger_Weber_Si__MO_405512056662_004 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model1_Si__MO_800412945727_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model1_Si__MO_800412945727_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model2_Si__MO_475612090600_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model2_Si__MO_475612090600_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Model |
Model Title |
Test Result |
EDIP_JustoBazantKaxiras_1998_Si__MO_958932894036_002 |
EDIP model for Si developed by Justo et al. (1998) v002 |
view |
EDIP_LAMMPS_JiangMorganSzlufarska_2012_SiC__MO_667792548433_000 |
EDIP model for SiC developed by Jiang, Morgan, and Szlufarska (2012) v000 |
view |
EDIP_LAMMPS_JustoBazantKaxiras_1998_Si__MO_315965276297_000 |
EDIP model for Si developed by Justo et al. (1998) v000 |
view |
EDIP_LAMMPS_LucasBertolusPizzagalli_2009_SiC__MO_634310164305_000 |
EDIP potential for Si-C developed by Lucas, Bertolus, and Pizzagalli (2009) v000 |
view |
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003 |
Efficient 'universal' shifted Lennard-Jones model for all KIM API supported species developed by Elliott and Akerson (2015) v003 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_000 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v000 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_001 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v001 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_002 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v002 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_000 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v000 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_001 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v001 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_002 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v002 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_000 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v000 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_001 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v001 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_002 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v002 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_000 |
MEAM potential for Si developed by Huang et al. (2018) v000 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_001 |
MEAM potential for Si developed by Huang et al. (2018) v001 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_002 |
MEAM potential for Si developed by Huang et al. (2018) v002 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_000 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v000 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_001 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v001 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_002 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v002 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_000 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v000 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_001 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v001 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_002 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v002 |
view |
MEAM_LAMMPS_Lee_2007_Si__MO_774917820956_000 |
MEAM Potential for Si developed by Lee (2007) v000 |
view |
MEAM_LAMMPS_Lee_2007_Si__MO_774917820956_001 |
MEAM Potential for Si developed by Lee (2007) v001 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_000 |
MEAM potential for Si system developed by Lenosky et al. (2000) v000 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_001 |
MEAM potential for Si system developed by Lenosky et al. (2000) v001 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_002 |
MEAM potential for Si system developed by Lenosky et al. (2000) v002 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_000 |
MEAM potential for Si-C developed by Wagner (2007) v000 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_001 |
MEAM potential for Si-C developed by Wagner (2007) v001 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_002 |
MEAM potential for Si-C developed by Wagner (2007) v002 |
view |
MFF_MistriotisFlytzanisFarantos_1989_Si__MO_080526771943_001 |
MFF potential for Si developed by Mistriotis, Flytzanis and Farantos (1989) v001 |
view |
Sim_LAMMPS_ADP_StarikovGordeevLysogorskiy_2020_SiAuAl__SM_113843830602_000 |
LAMMPS ADP potential for the Si-Au-Al system developed by Starikov et al. (2020) v000 |
view |
Sim_LAMMPS_ADP_StarikovLopanitsynaSmirnova_2018_SiAu__SM_985135773293_000 |
LAMMPS ADP potential for the Si-Au system developed by Starikov et al. (2018) v000 |
view |
Sim_LAMMPS_EDIP_LucasBertolusPizzagalli_2009_SiC__SM_435704953434_000 |
LAMMPS EDIP potential for Si-C developed by Lucas, Bertolus, and Pizzagalli (2009) v000 |
view |
Sim_LAMMPS_GW_GaoWeber_2002_SiC__SM_606253546840_000 |
LAMMPS Gao-Weber potential for Si-C developed by Gao and Weber (2002) v000 |
view |
Sim_LAMMPS_GWZBL_Samolyuk_2016_SiC__SM_720598599889_000 |
LAMMPS Gao-Weber potential combined with a modified repulsive ZBL core function for the Si-C system developed by German Samolyuk (2016) v000 |
view |
Sim_LAMMPS_MEAM_CuiGaoCui_2012_LiSi__SM_562938628131_000 |
LAMMPS MEAM potential for Li-Si alloys developed by Cui et al. (2012) v000 |
view |
Sim_LAMMPS_MEAM_DuLenoskyHennig_2011_Si__SM_662785656123_000 |
LAMMPS Spline-based MEAM potential for Si system developed by Du et al. (2011) v000 |
view |
Sim_LAMMPS_MEAM_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__SM_656517352485_000 |
LAMMPS MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v000 |
view |
Sim_LAMMPS_MEAM_LenoskySadighAlonso_2000_Si__SM_622320990752_000 |
LAMMPS MEAM potential for Si system developed by Lenosky et al. (2000) v000 |
view |
Sim_LAMMPS_MEAM_Wagner_2007_SiC__SM_264944083668_000 |
LAMMPS MEAM potential for Si-C developed by Wagner (2007) v000 |
view |
Sim_LAMMPS_ModifiedTersoff_KumagaiIzumiHara_2007_Si__SM_773333226968_000 |
LAMMPS Modified Tersoff potential for Si by Kumagai et al. (2007) v000 |
view |
Sim_LAMMPS_ModifiedTersoff_PurjaPunMishin_2017_Si__SM_184524061456_000 |
LAMMPS Modified Tersoff potential for Si developed by Purja Pun and Mishin (2017) v000 |
view |
Sim_LAMMPS_ReaxFF_BrugnoliMiyataniAkaji_SiCeNaClHO_2023__SM_282799919035_000 |
LAMMPS ReaxFF potential for Ceria/Silica/Water/NaCl developed by Brugnoli et al. (2023) v000 |
view |
Sim_LAMMPS_ReaxFF_ManzanoMoeiniMarinelli_2012_CaSiOH__SM_714124634215_000 |
LAMMPS ReaxFF potential for Ca-Si-O-H systems developed by Manzano et al. (2012) v000 |
view |
Sim_LAMMPS_TersoffZBL_DevanathanDiazdelaRubiaWeber_1998_SiC__SM_578912636995_000 |
LAMMPS Tersoff-ZBL potential for Si-C developed by Devanathan, Diaz de la Rubia, and Weber (1998) v000 |
view |
Sim_LAMMPS_Vashishta_BroughtonMeliVashishta_1997_SiO__SM_422553794879_000 |
LAMMPS Vashishta potential for the Si-O system developed by Broughton et al. (1997) v000 |
view |
Sim_LAMMPS_Vashishta_NakanoKaliaVashishta_1994_SiO__SM_503555646986_000 |
LAMMPS Vashishta potential for the Si-O system developed by Nakano et al. (1994) v000 |
view |
Sim_LAMMPS_Vashishta_VashishtaKaliaNakano_2007_SiC__SM_196548226654_000 |
LAMMPS Vashishta potential for the Si-C system developed by Vashishta et al. (2007) v000 |
view |
Sim_LAMMPS_Vashishta_VashishtaKaliaRino_1990_SiO__SM_887826436433_000 |
LAMMPS Vashishta potential for the Si-O system developed by Vashishta et al. (1990) v000 |
view |
SNAP_ZuoChenLi_2019_Si__MO_869330304805_000 |
A spectral neighbor analysis potential for Si developed by Yunxing Zuo v000 |
view |
SNAP_ZuoChenLi_2019quadratic_Si__MO_721469752060_000 |
A quadratic spectral neighbor analysis potential for Si developed by Yunxing Zuo v000 |
view |
SW_BalamaneHaliciogluTiller_1992_Si__MO_113686039439_004 |
Stillinger-Weber potential for Si developed by Balamane, Halicioglu and Tiller (1992) v004 |
view |
SW_BalamaneHaliciogluTiller_1992_Si__MO_113686039439_005 |
Stillinger-Weber potential for Si developed by Balamane, Halicioglu and Tiller (1992) v005 |
view |
SW_BalamaneHauchShi_2017Brittle_Si__MO_381114941873_002 |
Stillinger-Weber potential for brittle Si combining the modifications of Balamane et al. (1992) and Hauch et al. (1999) v002 |
view |
SW_BalamaneHauchShi_2017Brittle_Si__MO_381114941873_003 |
Stillinger-Weber potential for brittle Si combining the modifications of Balamane et al. (1992) and Hauch et al. (1999) v003 |
view |
SW_HauchHollandMarder_1999Brittle_Si__MO_119167353542_004 |
Stillinger-Weber potential for brittle Si due to Hauch et al. (1999) v004 |
view |
SW_HauchHollandMarder_1999Brittle_Si__MO_119167353542_005 |
Stillinger-Weber potential for brittle Si due to Hauch et al. (1999) v005 |
view |
SW_LeeHwang_2012GGA_Si__MO_040570764911_000 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); GGA parameterization v000 |
view |
SW_LeeHwang_2012GGA_Si__MO_040570764911_001 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); GGA parameterization v001 |
view |
SW_LeeHwang_2012LDA_Si__MO_517338295712_000 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); LDA parameterization v000 |
view |
SW_LeeHwang_2012LDA_Si__MO_517338295712_001 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); LDA parameterization v001 |
view |
SW_StillingerWeber_1985_Si__MO_405512056662_005 |
Stillinger-Weber potential for Si due to Stillinger and Weber (1985) v005 |
view |
SW_StillingerWeber_1985_Si__MO_405512056662_006 |
Stillinger-Weber potential for Si due to Stillinger and Weber (1985) v006 |
view |
SW_ZhangXieHu_2014OptimizedSW1_Si__MO_800412945727_004 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW1' v004 |
view |
SW_ZhangXieHu_2014OptimizedSW1_Si__MO_800412945727_005 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW1' v005 |
view |
SW_ZhangXieHu_2014OptimizedSW2_Si__MO_475612090600_004 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW2' v004 |
view |
SW_ZhangXieHu_2014OptimizedSW2_Si__MO_475612090600_005 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW2' v005 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_003 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v003 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_004 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v004 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_005 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v005 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_002 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v002 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_003 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v003 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_004 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v004 |
view |
Tersoff_LAMMPS_MunetohMotookaMoriguchi_2007_SiO__MO_501246546792_000 |
Tersoff-style three-body potential for SiO developed by Munetoh et al. (2007) v000 |
view |
Tersoff_LAMMPS_PlummerTucker_2019_TiSiC__MO_751442731010_000 |
Tersoff-style three-body potential for TiSiC developed by Plummer and Tucker (2019) v000 |
view |
Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_002 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v002 |
view |
Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_003 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v003 |
view |
Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_004 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v004 |
view |
Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_002 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v002 |
view |
Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_003 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v003 |
view |
Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_004 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v004 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiC__MO_171585019474_002 |
Tersoff-style three-body potential for SiC developed by Tersoff (1989) v002 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiC__MO_171585019474_003 |
Tersoff-style three-body potential for SiC developed by Tersoff (1989) v003 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_002 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v002 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_003 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v003 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_004 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v004 |
view |
Tersoff_LAMMPS_Tersoff_1990_SiC__MO_444207127575_000 |
Tersoff-style three-body potential for SiC developed by Tersoff (1990) v000 |
view |
Tersoff_LAMMPS_Tersoff_1994_SiC__MO_794973922560_000 |
Tersoff-style three-body potential for SiC developed by Tersoff (1994) v000 |
view |
ThreeBodyBondOrder_KDS_KhorDasSarma_1988_Si__MO_722489435928_000 |
Three-body cluster potential for Si by Khor and Das Sarma (1988) v000 |
view |
ThreeBodyBondOrder_PPM_PurjaPunMishin_2017_Si__MO_566683736730_000 |
Three-body bond-order potential for Si by Purja Pun and Mishin (2017) v000 |
view |
ThreeBodyBondOrder_WR_WangRockett_1991_Si__MO_081872846741_000 |
Three-body bond-order potential for Si by Wang and Rockett (1991) v000 |
view |
ThreeBodyCluster_BH_BiswasHamann_1987_Si__MO_019616213550_000 |
Three-body cluster potential for Si by Biswas and Hamann (1987) v000 |
view |
ThreeBodyCluster_Gong_Gong_1993_Si__MO_407755720412_000 |
Three-body cluster potential for Si by Gong (1993) v000 |
view |
ThreeBodyCluster_KP_KaxirasPandey_1988_Si__MO_072486242437_000 |
Three-body cluster potential for Si by Kaxiras and Pandey (1988) v000 |
view |
ThreeBodyCluster_SRS_StephensonRadnySmith_1996_Si__MO_604248666067_000 |
Three-body cluster potential for Si by Stephenson, Radny and Smith (1996) v000 |
view |
TorchML_MACE_GuptaTadmorMartiniani_2024_Si__MO_781946209112_000 |
Parallel MACE Equivariant GNN for Si developed by Gupta et al. (2024) v000 |
view |
TorchML_NequIP_GuptaTadmorMartiniani_2024_Si__MO_196181738937_000 |
Parallel NequIP Equivariant GNN for Si developed by Gupta et al. (2024) v000 |
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Model |
Model Title |
Test Result |
EDIP_BOP_Bazant_Kaxiras_Si__MO_958932894036_001 |
Original EDIP potential for elemental silicon. |
view |
Four_Body_Mistriotis_Flytzanis_Farantos_Si__MO_080526771943_000 |
A four-body Mistriotis-Flytzanis-Farantos Model for Silicon |
view |
LennardJones612_UniversalShifted__MO_959249795837_002 |
Efficient "universal" shifted Lennard-Jones model for all KIM API supported species |
view |
Tersoff_LAMMPS_Erhart_Albe_CSi__MO_903987585848_001 |
Tersoff-style three-body potential for SiC by Erhart/Albe |
view |
Tersoff_LAMMPS_Erhart_Albe_CSi__MO_903987585848_002 |
Tersoff-style three-body potential for SiC by Erhart/Albe |
view |
Tersoff_LAMMPS_Erhart_Albe_SiII_CSi__MO_408791041969_000 |
Tersoff-style three-body potential for SiC by Erhart/Albe, parameter set Si II |
view |
Tersoff_LAMMPS_Erhart_Albe_SiII_CSi__MO_408791041969_001 |
Tersoff-style three-body potential for SiC by Erhart/Albe, parameter set Si II |
view |
Tersoff_LAMMPS_Tersoff_PRB37_1988_Si__MO_245095684871_000 |
Tersoff's silicon potential (PRB 37, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB37_1988_Si__MO_245095684871_001 |
Tersoff's silicon potential (PRB 37, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB38_1988_Si__MO_186459956893_000 |
Tersoff's silicon potential (PRB 38, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB38_1988_Si__MO_186459956893_001 |
Tersoff's silicon potential (PRB 38, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_CSi__MO_171585019474_000 |
Tersoff's silicon carbide potential (PRB 39, 1989) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_CSi__MO_171585019474_001 |
Tersoff's silicon carbide potential (PRB 39, 1989) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_GeSi__MO_350526375143_000 |
Tersoff's silicon germanium potential (PRB 39, 1989) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_GeSi__MO_350526375143_001 |
Tersoff's silicon germanium potential (PRB 39, 1989) |
view |
Three_Body_Stillinger_Weber_Balamane_Hauch_Brittle_Si__MO_381114941873_000 |
Three Body Stillinger Weber Combined Balamane and Hauch Brittle Silicon |
view |
Three_Body_Stillinger_Weber_Balamane_Hauch_Brittle_Si__MO_381114941873_001 |
Three Body Stillinger Weber Combined Balamane and Hauch Brittle Silicon |
view |
Three_Body_Stillinger_Weber_Balamane_Si__MO_113686039439_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Balamane et al |
view |
Three_Body_Stillinger_Weber_Balamane_Si__MO_113686039439_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Balamane et al |
view |
Three_Body_Stillinger_Weber_Hauch_Brittle_Si__MO_119167353542_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Hauch et al |
view |
Three_Body_Stillinger_Weber_Hauch_Brittle_Si__MO_119167353542_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Hauch et al |
view |
Three_Body_Stillinger_Weber_Si__MO_405512056662_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon |
view |
Three_Body_Stillinger_Weber_Si__MO_405512056662_004 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model1_Si__MO_800412945727_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model1_Si__MO_800412945727_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model2_Si__MO_475612090600_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model2_Si__MO_475612090600_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Model |
Model Title |
Test Result |
EDIP_JustoBazantKaxiras_1998_Si__MO_958932894036_002 |
EDIP model for Si developed by Justo et al. (1998) v002 |
view |
EDIP_LAMMPS_JiangMorganSzlufarska_2012_SiC__MO_667792548433_000 |
EDIP model for SiC developed by Jiang, Morgan, and Szlufarska (2012) v000 |
view |
EDIP_LAMMPS_JustoBazantKaxiras_1998_Si__MO_315965276297_000 |
EDIP model for Si developed by Justo et al. (1998) v000 |
view |
EDIP_LAMMPS_LucasBertolusPizzagalli_2009_SiC__MO_634310164305_000 |
EDIP potential for Si-C developed by Lucas, Bertolus, and Pizzagalli (2009) v000 |
view |
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003 |
Efficient 'universal' shifted Lennard-Jones model for all KIM API supported species developed by Elliott and Akerson (2015) v003 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_000 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v000 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_001 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v001 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_002 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v002 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_000 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v000 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_001 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v001 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_002 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v002 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_000 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v000 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_001 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v001 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_002 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v002 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_000 |
MEAM potential for Si developed by Huang et al. (2018) v000 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_001 |
MEAM potential for Si developed by Huang et al. (2018) v001 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_002 |
MEAM potential for Si developed by Huang et al. (2018) v002 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_000 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v000 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_001 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v001 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_002 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v002 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_000 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v000 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_001 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v001 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_002 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v002 |
view |
MEAM_LAMMPS_Lee_2007_Si__MO_774917820956_000 |
MEAM Potential for Si developed by Lee (2007) v000 |
view |
MEAM_LAMMPS_Lee_2007_Si__MO_774917820956_001 |
MEAM Potential for Si developed by Lee (2007) v001 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_000 |
MEAM potential for Si system developed by Lenosky et al. (2000) v000 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_001 |
MEAM potential for Si system developed by Lenosky et al. (2000) v001 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_002 |
MEAM potential for Si system developed by Lenosky et al. (2000) v002 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_000 |
MEAM potential for Si-C developed by Wagner (2007) v000 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_001 |
MEAM potential for Si-C developed by Wagner (2007) v001 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_002 |
MEAM potential for Si-C developed by Wagner (2007) v002 |
view |
MFF_MistriotisFlytzanisFarantos_1989_Si__MO_080526771943_001 |
MFF potential for Si developed by Mistriotis, Flytzanis and Farantos (1989) v001 |
view |
Sim_LAMMPS_ADP_StarikovGordeevLysogorskiy_2020_SiAuAl__SM_113843830602_000 |
LAMMPS ADP potential for the Si-Au-Al system developed by Starikov et al. (2020) v000 |
view |
Sim_LAMMPS_ADP_StarikovLopanitsynaSmirnova_2018_SiAu__SM_985135773293_000 |
LAMMPS ADP potential for the Si-Au system developed by Starikov et al. (2018) v000 |
view |
Sim_LAMMPS_EDIP_LucasBertolusPizzagalli_2009_SiC__SM_435704953434_000 |
LAMMPS EDIP potential for Si-C developed by Lucas, Bertolus, and Pizzagalli (2009) v000 |
view |
Sim_LAMMPS_GW_GaoWeber_2002_SiC__SM_606253546840_000 |
LAMMPS Gao-Weber potential for Si-C developed by Gao and Weber (2002) v000 |
view |
Sim_LAMMPS_GWZBL_Samolyuk_2016_SiC__SM_720598599889_000 |
LAMMPS Gao-Weber potential combined with a modified repulsive ZBL core function for the Si-C system developed by German Samolyuk (2016) v000 |
view |
Sim_LAMMPS_MEAM_CuiGaoCui_2012_LiSi__SM_562938628131_000 |
LAMMPS MEAM potential for Li-Si alloys developed by Cui et al. (2012) v000 |
view |
Sim_LAMMPS_MEAM_DuLenoskyHennig_2011_Si__SM_662785656123_000 |
LAMMPS Spline-based MEAM potential for Si system developed by Du et al. (2011) v000 |
view |
Sim_LAMMPS_MEAM_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__SM_656517352485_000 |
LAMMPS MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v000 |
view |
Sim_LAMMPS_MEAM_LenoskySadighAlonso_2000_Si__SM_622320990752_000 |
LAMMPS MEAM potential for Si system developed by Lenosky et al. (2000) v000 |
view |
Sim_LAMMPS_MEAM_Wagner_2007_SiC__SM_264944083668_000 |
LAMMPS MEAM potential for Si-C developed by Wagner (2007) v000 |
view |
Sim_LAMMPS_ModifiedTersoff_KumagaiIzumiHara_2007_Si__SM_773333226968_000 |
LAMMPS Modified Tersoff potential for Si by Kumagai et al. (2007) v000 |
view |
Sim_LAMMPS_ModifiedTersoff_PurjaPunMishin_2017_Si__SM_184524061456_000 |
LAMMPS Modified Tersoff potential for Si developed by Purja Pun and Mishin (2017) v000 |
view |
Sim_LAMMPS_ReaxFF_BrugnoliMiyataniAkaji_SiCeNaClHO_2023__SM_282799919035_000 |
LAMMPS ReaxFF potential for Ceria/Silica/Water/NaCl developed by Brugnoli et al. (2023) v000 |
view |
Sim_LAMMPS_ReaxFF_ManzanoMoeiniMarinelli_2012_CaSiOH__SM_714124634215_000 |
LAMMPS ReaxFF potential for Ca-Si-O-H systems developed by Manzano et al. (2012) v000 |
view |
Sim_LAMMPS_TersoffZBL_DevanathanDiazdelaRubiaWeber_1998_SiC__SM_578912636995_000 |
LAMMPS Tersoff-ZBL potential for Si-C developed by Devanathan, Diaz de la Rubia, and Weber (1998) v000 |
view |
Sim_LAMMPS_Vashishta_BroughtonMeliVashishta_1997_SiO__SM_422553794879_000 |
LAMMPS Vashishta potential for the Si-O system developed by Broughton et al. (1997) v000 |
view |
Sim_LAMMPS_Vashishta_NakanoKaliaVashishta_1994_SiO__SM_503555646986_000 |
LAMMPS Vashishta potential for the Si-O system developed by Nakano et al. (1994) v000 |
view |
Sim_LAMMPS_Vashishta_VashishtaKaliaNakano_2007_SiC__SM_196548226654_000 |
LAMMPS Vashishta potential for the Si-C system developed by Vashishta et al. (2007) v000 |
view |
Sim_LAMMPS_Vashishta_VashishtaKaliaRino_1990_SiO__SM_887826436433_000 |
LAMMPS Vashishta potential for the Si-O system developed by Vashishta et al. (1990) v000 |
view |
SNAP_ZuoChenLi_2019_Si__MO_869330304805_000 |
A spectral neighbor analysis potential for Si developed by Yunxing Zuo v000 |
view |
SNAP_ZuoChenLi_2019quadratic_Si__MO_721469752060_000 |
A quadratic spectral neighbor analysis potential for Si developed by Yunxing Zuo v000 |
view |
SW_BalamaneHaliciogluTiller_1992_Si__MO_113686039439_004 |
Stillinger-Weber potential for Si developed by Balamane, Halicioglu and Tiller (1992) v004 |
view |
SW_BalamaneHaliciogluTiller_1992_Si__MO_113686039439_005 |
Stillinger-Weber potential for Si developed by Balamane, Halicioglu and Tiller (1992) v005 |
view |
SW_BalamaneHauchShi_2017Brittle_Si__MO_381114941873_002 |
Stillinger-Weber potential for brittle Si combining the modifications of Balamane et al. (1992) and Hauch et al. (1999) v002 |
view |
SW_BalamaneHauchShi_2017Brittle_Si__MO_381114941873_003 |
Stillinger-Weber potential for brittle Si combining the modifications of Balamane et al. (1992) and Hauch et al. (1999) v003 |
view |
SW_HauchHollandMarder_1999Brittle_Si__MO_119167353542_004 |
Stillinger-Weber potential for brittle Si due to Hauch et al. (1999) v004 |
view |
SW_HauchHollandMarder_1999Brittle_Si__MO_119167353542_005 |
Stillinger-Weber potential for brittle Si due to Hauch et al. (1999) v005 |
view |
SW_LeeHwang_2012GGA_Si__MO_040570764911_000 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); GGA parameterization v000 |
view |
SW_LeeHwang_2012GGA_Si__MO_040570764911_001 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); GGA parameterization v001 |
view |
SW_LeeHwang_2012LDA_Si__MO_517338295712_000 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); LDA parameterization v000 |
view |
SW_LeeHwang_2012LDA_Si__MO_517338295712_001 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); LDA parameterization v001 |
view |
SW_StillingerWeber_1985_Si__MO_405512056662_005 |
Stillinger-Weber potential for Si due to Stillinger and Weber (1985) v005 |
view |
SW_StillingerWeber_1985_Si__MO_405512056662_006 |
Stillinger-Weber potential for Si due to Stillinger and Weber (1985) v006 |
view |
SW_ZhangXieHu_2014OptimizedSW1_Si__MO_800412945727_004 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW1' v004 |
view |
SW_ZhangXieHu_2014OptimizedSW1_Si__MO_800412945727_005 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW1' v005 |
view |
SW_ZhangXieHu_2014OptimizedSW2_Si__MO_475612090600_004 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW2' v004 |
view |
SW_ZhangXieHu_2014OptimizedSW2_Si__MO_475612090600_005 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW2' v005 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_003 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v003 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_004 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v004 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_005 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v005 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_002 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v002 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_003 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v003 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_004 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v004 |
view |
Tersoff_LAMMPS_MunetohMotookaMoriguchi_2007_SiO__MO_501246546792_000 |
Tersoff-style three-body potential for SiO developed by Munetoh et al. (2007) v000 |
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Tersoff_LAMMPS_PlummerTucker_2019_TiSiC__MO_751442731010_000 |
Tersoff-style three-body potential for TiSiC developed by Plummer and Tucker (2019) v000 |
view |
Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_002 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v002 |
view |
Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_003 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v003 |
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Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_004 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v004 |
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Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_002 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v002 |
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Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_003 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v003 |
view |
Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_004 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v004 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiC__MO_171585019474_002 |
Tersoff-style three-body potential for SiC developed by Tersoff (1989) v002 |
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Tersoff_LAMMPS_Tersoff_1989_SiC__MO_171585019474_003 |
Tersoff-style three-body potential for SiC developed by Tersoff (1989) v003 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_002 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v002 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_003 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v003 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_004 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v004 |
view |
Tersoff_LAMMPS_Tersoff_1990_SiC__MO_444207127575_000 |
Tersoff-style three-body potential for SiC developed by Tersoff (1990) v000 |
view |
Tersoff_LAMMPS_Tersoff_1994_SiC__MO_794973922560_000 |
Tersoff-style three-body potential for SiC developed by Tersoff (1994) v000 |
view |
ThreeBodyBondOrder_KDS_KhorDasSarma_1988_Si__MO_722489435928_000 |
Three-body cluster potential for Si by Khor and Das Sarma (1988) v000 |
view |
ThreeBodyBondOrder_PPM_PurjaPunMishin_2017_Si__MO_566683736730_000 |
Three-body bond-order potential for Si by Purja Pun and Mishin (2017) v000 |
view |
ThreeBodyBondOrder_WR_WangRockett_1991_Si__MO_081872846741_000 |
Three-body bond-order potential for Si by Wang and Rockett (1991) v000 |
view |
ThreeBodyCluster_BH_BiswasHamann_1987_Si__MO_019616213550_000 |
Three-body cluster potential for Si by Biswas and Hamann (1987) v000 |
view |
ThreeBodyCluster_Gong_Gong_1993_Si__MO_407755720412_000 |
Three-body cluster potential for Si by Gong (1993) v000 |
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ThreeBodyCluster_KP_KaxirasPandey_1988_Si__MO_072486242437_000 |
Three-body cluster potential for Si by Kaxiras and Pandey (1988) v000 |
view |
ThreeBodyCluster_SRS_StephensonRadnySmith_1996_Si__MO_604248666067_000 |
Three-body cluster potential for Si by Stephenson, Radny and Smith (1996) v000 |
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TorchML_NequIP_GuptaTadmorMartiniani_2024_Si__MO_196181738937_000 |
Parallel NequIP Equivariant GNN for Si developed by Gupta et al. (2024) v000 |
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Model |
Model Title |
Test Result |
EDIP_BOP_Bazant_Kaxiras_Si__MO_958932894036_001 |
Original EDIP potential for elemental silicon. |
view |
Four_Body_Mistriotis_Flytzanis_Farantos_Si__MO_080526771943_000 |
A four-body Mistriotis-Flytzanis-Farantos Model for Silicon |
view |
LennardJones612_UniversalShifted__MO_959249795837_002 |
Efficient "universal" shifted Lennard-Jones model for all KIM API supported species |
view |
Tersoff_LAMMPS_Erhart_Albe_CSi__MO_903987585848_001 |
Tersoff-style three-body potential for SiC by Erhart/Albe |
view |
Tersoff_LAMMPS_Erhart_Albe_CSi__MO_903987585848_002 |
Tersoff-style three-body potential for SiC by Erhart/Albe |
view |
Tersoff_LAMMPS_Erhart_Albe_SiII_CSi__MO_408791041969_000 |
Tersoff-style three-body potential for SiC by Erhart/Albe, parameter set Si II |
view |
Tersoff_LAMMPS_Erhart_Albe_SiII_CSi__MO_408791041969_001 |
Tersoff-style three-body potential for SiC by Erhart/Albe, parameter set Si II |
view |
Tersoff_LAMMPS_Tersoff_PRB37_1988_Si__MO_245095684871_000 |
Tersoff's silicon potential (PRB 37, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB37_1988_Si__MO_245095684871_001 |
Tersoff's silicon potential (PRB 37, 1988) |
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Tersoff_LAMMPS_Tersoff_PRB38_1988_Si__MO_186459956893_000 |
Tersoff's silicon potential (PRB 38, 1988) |
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Tersoff_LAMMPS_Tersoff_PRB38_1988_Si__MO_186459956893_001 |
Tersoff's silicon potential (PRB 38, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_CSi__MO_171585019474_000 |
Tersoff's silicon carbide potential (PRB 39, 1989) |
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Tersoff_LAMMPS_Tersoff_PRB39_1989_CSi__MO_171585019474_001 |
Tersoff's silicon carbide potential (PRB 39, 1989) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_GeSi__MO_350526375143_000 |
Tersoff's silicon germanium potential (PRB 39, 1989) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_GeSi__MO_350526375143_001 |
Tersoff's silicon germanium potential (PRB 39, 1989) |
view |
Three_Body_Stillinger_Weber_Balamane_Hauch_Brittle_Si__MO_381114941873_000 |
Three Body Stillinger Weber Combined Balamane and Hauch Brittle Silicon |
view |
Three_Body_Stillinger_Weber_Balamane_Hauch_Brittle_Si__MO_381114941873_001 |
Three Body Stillinger Weber Combined Balamane and Hauch Brittle Silicon |
view |
Three_Body_Stillinger_Weber_Balamane_Si__MO_113686039439_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Balamane et al |
view |
Three_Body_Stillinger_Weber_Balamane_Si__MO_113686039439_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Balamane et al |
view |
Three_Body_Stillinger_Weber_Hauch_Brittle_Si__MO_119167353542_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Hauch et al |
view |
Three_Body_Stillinger_Weber_Hauch_Brittle_Si__MO_119167353542_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Hauch et al |
view |
Three_Body_Stillinger_Weber_Si__MO_405512056662_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon |
view |
Three_Body_Stillinger_Weber_Si__MO_405512056662_004 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model1_Si__MO_800412945727_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model1_Si__MO_800412945727_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model2_Si__MO_475612090600_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model2_Si__MO_475612090600_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Model |
Model Title |
Test Result |
EDIP_JustoBazantKaxiras_1998_Si__MO_958932894036_002 |
EDIP model for Si developed by Justo et al. (1998) v002 |
view |
EDIP_LAMMPS_JiangMorganSzlufarska_2012_SiC__MO_667792548433_000 |
EDIP model for SiC developed by Jiang, Morgan, and Szlufarska (2012) v000 |
view |
EDIP_LAMMPS_JustoBazantKaxiras_1998_Si__MO_315965276297_000 |
EDIP model for Si developed by Justo et al. (1998) v000 |
view |
EDIP_LAMMPS_LucasBertolusPizzagalli_2009_SiC__MO_634310164305_000 |
EDIP potential for Si-C developed by Lucas, Bertolus, and Pizzagalli (2009) v000 |
view |
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003 |
Efficient 'universal' shifted Lennard-Jones model for all KIM API supported species developed by Elliott and Akerson (2015) v003 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_000 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v000 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_001 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v001 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_002 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v002 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_000 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v000 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_001 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v001 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_002 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v002 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_000 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v000 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_001 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v001 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_002 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v002 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_000 |
MEAM potential for Si developed by Huang et al. (2018) v000 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_001 |
MEAM potential for Si developed by Huang et al. (2018) v001 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_002 |
MEAM potential for Si developed by Huang et al. (2018) v002 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_000 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v000 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_001 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v001 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_002 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v002 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_000 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v000 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_001 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v001 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_002 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v002 |
view |
MEAM_LAMMPS_Lee_2007_Si__MO_774917820956_000 |
MEAM Potential for Si developed by Lee (2007) v000 |
view |
MEAM_LAMMPS_Lee_2007_Si__MO_774917820956_001 |
MEAM Potential for Si developed by Lee (2007) v001 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_000 |
MEAM potential for Si system developed by Lenosky et al. (2000) v000 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_001 |
MEAM potential for Si system developed by Lenosky et al. (2000) v001 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_002 |
MEAM potential for Si system developed by Lenosky et al. (2000) v002 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_000 |
MEAM potential for Si-C developed by Wagner (2007) v000 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_001 |
MEAM potential for Si-C developed by Wagner (2007) v001 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_002 |
MEAM potential for Si-C developed by Wagner (2007) v002 |
view |
MFF_MistriotisFlytzanisFarantos_1989_Si__MO_080526771943_001 |
MFF potential for Si developed by Mistriotis, Flytzanis and Farantos (1989) v001 |
view |
Sim_LAMMPS_ADP_StarikovGordeevLysogorskiy_2020_SiAuAl__SM_113843830602_000 |
LAMMPS ADP potential for the Si-Au-Al system developed by Starikov et al. (2020) v000 |
view |
Sim_LAMMPS_ADP_StarikovLopanitsynaSmirnova_2018_SiAu__SM_985135773293_000 |
LAMMPS ADP potential for the Si-Au system developed by Starikov et al. (2018) v000 |
view |
Sim_LAMMPS_EDIP_LucasBertolusPizzagalli_2009_SiC__SM_435704953434_000 |
LAMMPS EDIP potential for Si-C developed by Lucas, Bertolus, and Pizzagalli (2009) v000 |
view |
Sim_LAMMPS_GW_GaoWeber_2002_SiC__SM_606253546840_000 |
LAMMPS Gao-Weber potential for Si-C developed by Gao and Weber (2002) v000 |
view |
Sim_LAMMPS_GWZBL_Samolyuk_2016_SiC__SM_720598599889_000 |
LAMMPS Gao-Weber potential combined with a modified repulsive ZBL core function for the Si-C system developed by German Samolyuk (2016) v000 |
view |
Sim_LAMMPS_MEAM_CuiGaoCui_2012_LiSi__SM_562938628131_000 |
LAMMPS MEAM potential for Li-Si alloys developed by Cui et al. (2012) v000 |
view |
Sim_LAMMPS_MEAM_DuLenoskyHennig_2011_Si__SM_662785656123_000 |
LAMMPS Spline-based MEAM potential for Si system developed by Du et al. (2011) v000 |
view |
Sim_LAMMPS_MEAM_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__SM_656517352485_000 |
LAMMPS MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v000 |
view |
Sim_LAMMPS_MEAM_LenoskySadighAlonso_2000_Si__SM_622320990752_000 |
LAMMPS MEAM potential for Si system developed by Lenosky et al. (2000) v000 |
view |
Sim_LAMMPS_MEAM_Wagner_2007_SiC__SM_264944083668_000 |
LAMMPS MEAM potential for Si-C developed by Wagner (2007) v000 |
view |
Sim_LAMMPS_ModifiedTersoff_KumagaiIzumiHara_2007_Si__SM_773333226968_000 |
LAMMPS Modified Tersoff potential for Si by Kumagai et al. (2007) v000 |
view |
Sim_LAMMPS_ModifiedTersoff_PurjaPunMishin_2017_Si__SM_184524061456_000 |
LAMMPS Modified Tersoff potential for Si developed by Purja Pun and Mishin (2017) v000 |
view |
Sim_LAMMPS_ReaxFF_BrugnoliMiyataniAkaji_SiCeNaClHO_2023__SM_282799919035_000 |
LAMMPS ReaxFF potential for Ceria/Silica/Water/NaCl developed by Brugnoli et al. (2023) v000 |
view |
Sim_LAMMPS_ReaxFF_ManzanoMoeiniMarinelli_2012_CaSiOH__SM_714124634215_000 |
LAMMPS ReaxFF potential for Ca-Si-O-H systems developed by Manzano et al. (2012) v000 |
view |
Sim_LAMMPS_TersoffZBL_DevanathanDiazdelaRubiaWeber_1998_SiC__SM_578912636995_000 |
LAMMPS Tersoff-ZBL potential for Si-C developed by Devanathan, Diaz de la Rubia, and Weber (1998) v000 |
view |
Sim_LAMMPS_Vashishta_BroughtonMeliVashishta_1997_SiO__SM_422553794879_000 |
LAMMPS Vashishta potential for the Si-O system developed by Broughton et al. (1997) v000 |
view |
Sim_LAMMPS_Vashishta_NakanoKaliaVashishta_1994_SiO__SM_503555646986_000 |
LAMMPS Vashishta potential for the Si-O system developed by Nakano et al. (1994) v000 |
view |
Sim_LAMMPS_Vashishta_VashishtaKaliaNakano_2007_SiC__SM_196548226654_000 |
LAMMPS Vashishta potential for the Si-C system developed by Vashishta et al. (2007) v000 |
view |
Sim_LAMMPS_Vashishta_VashishtaKaliaRino_1990_SiO__SM_887826436433_000 |
LAMMPS Vashishta potential for the Si-O system developed by Vashishta et al. (1990) v000 |
view |
SNAP_ZuoChenLi_2019_Si__MO_869330304805_000 |
A spectral neighbor analysis potential for Si developed by Yunxing Zuo v000 |
view |
SNAP_ZuoChenLi_2019quadratic_Si__MO_721469752060_000 |
A quadratic spectral neighbor analysis potential for Si developed by Yunxing Zuo v000 |
view |
SW_BalamaneHaliciogluTiller_1992_Si__MO_113686039439_004 |
Stillinger-Weber potential for Si developed by Balamane, Halicioglu and Tiller (1992) v004 |
view |
SW_BalamaneHaliciogluTiller_1992_Si__MO_113686039439_005 |
Stillinger-Weber potential for Si developed by Balamane, Halicioglu and Tiller (1992) v005 |
view |
SW_BalamaneHauchShi_2017Brittle_Si__MO_381114941873_002 |
Stillinger-Weber potential for brittle Si combining the modifications of Balamane et al. (1992) and Hauch et al. (1999) v002 |
view |
SW_BalamaneHauchShi_2017Brittle_Si__MO_381114941873_003 |
Stillinger-Weber potential for brittle Si combining the modifications of Balamane et al. (1992) and Hauch et al. (1999) v003 |
view |
SW_HauchHollandMarder_1999Brittle_Si__MO_119167353542_004 |
Stillinger-Weber potential for brittle Si due to Hauch et al. (1999) v004 |
view |
SW_HauchHollandMarder_1999Brittle_Si__MO_119167353542_005 |
Stillinger-Weber potential for brittle Si due to Hauch et al. (1999) v005 |
view |
SW_LeeHwang_2012GGA_Si__MO_040570764911_000 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); GGA parameterization v000 |
view |
SW_LeeHwang_2012GGA_Si__MO_040570764911_001 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); GGA parameterization v001 |
view |
SW_LeeHwang_2012LDA_Si__MO_517338295712_000 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); LDA parameterization v000 |
view |
SW_LeeHwang_2012LDA_Si__MO_517338295712_001 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); LDA parameterization v001 |
view |
SW_StillingerWeber_1985_Si__MO_405512056662_005 |
Stillinger-Weber potential for Si due to Stillinger and Weber (1985) v005 |
view |
SW_StillingerWeber_1985_Si__MO_405512056662_006 |
Stillinger-Weber potential for Si due to Stillinger and Weber (1985) v006 |
view |
SW_ZhangXieHu_2014OptimizedSW1_Si__MO_800412945727_004 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW1' v004 |
view |
SW_ZhangXieHu_2014OptimizedSW1_Si__MO_800412945727_005 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW1' v005 |
view |
SW_ZhangXieHu_2014OptimizedSW2_Si__MO_475612090600_004 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW2' v004 |
view |
SW_ZhangXieHu_2014OptimizedSW2_Si__MO_475612090600_005 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW2' v005 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_003 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v003 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_004 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v004 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_005 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v005 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_002 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v002 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_003 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v003 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_004 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v004 |
view |
Tersoff_LAMMPS_MunetohMotookaMoriguchi_2007_SiO__MO_501246546792_000 |
Tersoff-style three-body potential for SiO developed by Munetoh et al. (2007) v000 |
view |
Tersoff_LAMMPS_PlummerTucker_2019_TiSiC__MO_751442731010_000 |
Tersoff-style three-body potential for TiSiC developed by Plummer and Tucker (2019) v000 |
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Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_002 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v002 |
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Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_003 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v003 |
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Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_004 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v004 |
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Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_002 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v002 |
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Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_003 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v003 |
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Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_004 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v004 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiC__MO_171585019474_002 |
Tersoff-style three-body potential for SiC developed by Tersoff (1989) v002 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiC__MO_171585019474_003 |
Tersoff-style three-body potential for SiC developed by Tersoff (1989) v003 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_002 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v002 |
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Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_003 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v003 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_004 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v004 |
view |
Tersoff_LAMMPS_Tersoff_1990_SiC__MO_444207127575_000 |
Tersoff-style three-body potential for SiC developed by Tersoff (1990) v000 |
view |
Tersoff_LAMMPS_Tersoff_1994_SiC__MO_794973922560_000 |
Tersoff-style three-body potential for SiC developed by Tersoff (1994) v000 |
view |
ThreeBodyBondOrder_KDS_KhorDasSarma_1988_Si__MO_722489435928_000 |
Three-body cluster potential for Si by Khor and Das Sarma (1988) v000 |
view |
ThreeBodyBondOrder_PPM_PurjaPunMishin_2017_Si__MO_566683736730_000 |
Three-body bond-order potential for Si by Purja Pun and Mishin (2017) v000 |
view |
ThreeBodyBondOrder_WR_WangRockett_1991_Si__MO_081872846741_000 |
Three-body bond-order potential for Si by Wang and Rockett (1991) v000 |
view |
ThreeBodyCluster_BH_BiswasHamann_1987_Si__MO_019616213550_000 |
Three-body cluster potential for Si by Biswas and Hamann (1987) v000 |
view |
ThreeBodyCluster_Gong_Gong_1993_Si__MO_407755720412_000 |
Three-body cluster potential for Si by Gong (1993) v000 |
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ThreeBodyCluster_KP_KaxirasPandey_1988_Si__MO_072486242437_000 |
Three-body cluster potential for Si by Kaxiras and Pandey (1988) v000 |
view |
ThreeBodyCluster_SRS_StephensonRadnySmith_1996_Si__MO_604248666067_000 |
Three-body cluster potential for Si by Stephenson, Radny and Smith (1996) v000 |
view |
TorchML_MACE_GuptaTadmorMartiniani_2024_Si__MO_781946209112_000 |
Parallel MACE Equivariant GNN for Si developed by Gupta et al. (2024) v000 |
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TorchML_NequIP_GuptaTadmorMartiniani_2024_Si__MO_196181738937_000 |
Parallel NequIP Equivariant GNN for Si developed by Gupta et al. (2024) v000 |
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Model |
Model Title |
Test Result |
EDIP_BOP_Bazant_Kaxiras_Si__MO_958932894036_001 |
Original EDIP potential for elemental silicon. |
view |
Four_Body_Mistriotis_Flytzanis_Farantos_Si__MO_080526771943_000 |
A four-body Mistriotis-Flytzanis-Farantos Model for Silicon |
view |
LennardJones612_UniversalShifted__MO_959249795837_002 |
Efficient "universal" shifted Lennard-Jones model for all KIM API supported species |
view |
Tersoff_LAMMPS_Erhart_Albe_CSi__MO_903987585848_001 |
Tersoff-style three-body potential for SiC by Erhart/Albe |
view |
Tersoff_LAMMPS_Erhart_Albe_CSi__MO_903987585848_002 |
Tersoff-style three-body potential for SiC by Erhart/Albe |
view |
Tersoff_LAMMPS_Erhart_Albe_SiII_CSi__MO_408791041969_000 |
Tersoff-style three-body potential for SiC by Erhart/Albe, parameter set Si II |
view |
Tersoff_LAMMPS_Erhart_Albe_SiII_CSi__MO_408791041969_001 |
Tersoff-style three-body potential for SiC by Erhart/Albe, parameter set Si II |
view |
Tersoff_LAMMPS_Tersoff_PRB37_1988_Si__MO_245095684871_000 |
Tersoff's silicon potential (PRB 37, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB37_1988_Si__MO_245095684871_001 |
Tersoff's silicon potential (PRB 37, 1988) |
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Tersoff_LAMMPS_Tersoff_PRB38_1988_Si__MO_186459956893_000 |
Tersoff's silicon potential (PRB 38, 1988) |
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Tersoff_LAMMPS_Tersoff_PRB38_1988_Si__MO_186459956893_001 |
Tersoff's silicon potential (PRB 38, 1988) |
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Tersoff_LAMMPS_Tersoff_PRB39_1989_CSi__MO_171585019474_000 |
Tersoff's silicon carbide potential (PRB 39, 1989) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_CSi__MO_171585019474_001 |
Tersoff's silicon carbide potential (PRB 39, 1989) |
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Tersoff_LAMMPS_Tersoff_PRB39_1989_GeSi__MO_350526375143_000 |
Tersoff's silicon germanium potential (PRB 39, 1989) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_GeSi__MO_350526375143_001 |
Tersoff's silicon germanium potential (PRB 39, 1989) |
view |
Three_Body_Stillinger_Weber_Balamane_Hauch_Brittle_Si__MO_381114941873_000 |
Three Body Stillinger Weber Combined Balamane and Hauch Brittle Silicon |
view |
Three_Body_Stillinger_Weber_Balamane_Hauch_Brittle_Si__MO_381114941873_001 |
Three Body Stillinger Weber Combined Balamane and Hauch Brittle Silicon |
view |
Three_Body_Stillinger_Weber_Balamane_Si__MO_113686039439_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Balamane et al |
view |
Three_Body_Stillinger_Weber_Balamane_Si__MO_113686039439_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Balamane et al |
view |
Three_Body_Stillinger_Weber_Hauch_Brittle_Si__MO_119167353542_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Hauch et al |
view |
Three_Body_Stillinger_Weber_Hauch_Brittle_Si__MO_119167353542_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Hauch et al |
view |
Three_Body_Stillinger_Weber_Si__MO_405512056662_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon |
view |
Three_Body_Stillinger_Weber_Si__MO_405512056662_004 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model1_Si__MO_800412945727_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model1_Si__MO_800412945727_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model2_Si__MO_475612090600_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model2_Si__MO_475612090600_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Model |
Model Title |
Test Result |
EDIP_JustoBazantKaxiras_1998_Si__MO_958932894036_002 |
EDIP model for Si developed by Justo et al. (1998) v002 |
view |
EDIP_LAMMPS_JiangMorganSzlufarska_2012_SiC__MO_667792548433_000 |
EDIP model for SiC developed by Jiang, Morgan, and Szlufarska (2012) v000 |
view |
EDIP_LAMMPS_JustoBazantKaxiras_1998_Si__MO_315965276297_000 |
EDIP model for Si developed by Justo et al. (1998) v000 |
view |
EDIP_LAMMPS_LucasBertolusPizzagalli_2009_SiC__MO_634310164305_000 |
EDIP potential for Si-C developed by Lucas, Bertolus, and Pizzagalli (2009) v000 |
view |
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003 |
Efficient 'universal' shifted Lennard-Jones model for all KIM API supported species developed by Elliott and Akerson (2015) v003 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_000 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v000 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_001 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v001 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_002 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v002 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_000 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v000 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_001 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v001 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_002 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v002 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_000 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v000 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_001 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v001 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_002 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v002 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_000 |
MEAM potential for Si developed by Huang et al. (2018) v000 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_001 |
MEAM potential for Si developed by Huang et al. (2018) v001 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_002 |
MEAM potential for Si developed by Huang et al. (2018) v002 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_000 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v000 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_001 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v001 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_002 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v002 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_000 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v000 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_001 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v001 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_002 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v002 |
view |
MEAM_LAMMPS_Lee_2007_Si__MO_774917820956_000 |
MEAM Potential for Si developed by Lee (2007) v000 |
view |
MEAM_LAMMPS_Lee_2007_Si__MO_774917820956_001 |
MEAM Potential for Si developed by Lee (2007) v001 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_000 |
MEAM potential for Si system developed by Lenosky et al. (2000) v000 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_001 |
MEAM potential for Si system developed by Lenosky et al. (2000) v001 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_002 |
MEAM potential for Si system developed by Lenosky et al. (2000) v002 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_000 |
MEAM potential for Si-C developed by Wagner (2007) v000 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_001 |
MEAM potential for Si-C developed by Wagner (2007) v001 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_002 |
MEAM potential for Si-C developed by Wagner (2007) v002 |
view |
MFF_MistriotisFlytzanisFarantos_1989_Si__MO_080526771943_001 |
MFF potential for Si developed by Mistriotis, Flytzanis and Farantos (1989) v001 |
view |
Sim_LAMMPS_ADP_StarikovGordeevLysogorskiy_2020_SiAuAl__SM_113843830602_000 |
LAMMPS ADP potential for the Si-Au-Al system developed by Starikov et al. (2020) v000 |
view |
Sim_LAMMPS_ADP_StarikovLopanitsynaSmirnova_2018_SiAu__SM_985135773293_000 |
LAMMPS ADP potential for the Si-Au system developed by Starikov et al. (2018) v000 |
view |
Sim_LAMMPS_EDIP_LucasBertolusPizzagalli_2009_SiC__SM_435704953434_000 |
LAMMPS EDIP potential for Si-C developed by Lucas, Bertolus, and Pizzagalli (2009) v000 |
view |
Sim_LAMMPS_GW_GaoWeber_2002_SiC__SM_606253546840_000 |
LAMMPS Gao-Weber potential for Si-C developed by Gao and Weber (2002) v000 |
view |
Sim_LAMMPS_GWZBL_Samolyuk_2016_SiC__SM_720598599889_000 |
LAMMPS Gao-Weber potential combined with a modified repulsive ZBL core function for the Si-C system developed by German Samolyuk (2016) v000 |
view |
Sim_LAMMPS_MEAM_CuiGaoCui_2012_LiSi__SM_562938628131_000 |
LAMMPS MEAM potential for Li-Si alloys developed by Cui et al. (2012) v000 |
view |
Sim_LAMMPS_MEAM_DuLenoskyHennig_2011_Si__SM_662785656123_000 |
LAMMPS Spline-based MEAM potential for Si system developed by Du et al. (2011) v000 |
view |
Sim_LAMMPS_MEAM_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__SM_656517352485_000 |
LAMMPS MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v000 |
view |
Sim_LAMMPS_MEAM_LenoskySadighAlonso_2000_Si__SM_622320990752_000 |
LAMMPS MEAM potential for Si system developed by Lenosky et al. (2000) v000 |
view |
Sim_LAMMPS_MEAM_Wagner_2007_SiC__SM_264944083668_000 |
LAMMPS MEAM potential for Si-C developed by Wagner (2007) v000 |
view |
Sim_LAMMPS_ModifiedTersoff_KumagaiIzumiHara_2007_Si__SM_773333226968_000 |
LAMMPS Modified Tersoff potential for Si by Kumagai et al. (2007) v000 |
view |
Sim_LAMMPS_ModifiedTersoff_PurjaPunMishin_2017_Si__SM_184524061456_000 |
LAMMPS Modified Tersoff potential for Si developed by Purja Pun and Mishin (2017) v000 |
view |
Sim_LAMMPS_ReaxFF_BrugnoliMiyataniAkaji_SiCeNaClHO_2023__SM_282799919035_000 |
LAMMPS ReaxFF potential for Ceria/Silica/Water/NaCl developed by Brugnoli et al. (2023) v000 |
view |
Sim_LAMMPS_ReaxFF_ManzanoMoeiniMarinelli_2012_CaSiOH__SM_714124634215_000 |
LAMMPS ReaxFF potential for Ca-Si-O-H systems developed by Manzano et al. (2012) v000 |
view |
Sim_LAMMPS_TersoffZBL_DevanathanDiazdelaRubiaWeber_1998_SiC__SM_578912636995_000 |
LAMMPS Tersoff-ZBL potential for Si-C developed by Devanathan, Diaz de la Rubia, and Weber (1998) v000 |
view |
Sim_LAMMPS_Vashishta_BroughtonMeliVashishta_1997_SiO__SM_422553794879_000 |
LAMMPS Vashishta potential for the Si-O system developed by Broughton et al. (1997) v000 |
view |
Sim_LAMMPS_Vashishta_NakanoKaliaVashishta_1994_SiO__SM_503555646986_000 |
LAMMPS Vashishta potential for the Si-O system developed by Nakano et al. (1994) v000 |
view |
Sim_LAMMPS_Vashishta_VashishtaKaliaNakano_2007_SiC__SM_196548226654_000 |
LAMMPS Vashishta potential for the Si-C system developed by Vashishta et al. (2007) v000 |
view |
Sim_LAMMPS_Vashishta_VashishtaKaliaRino_1990_SiO__SM_887826436433_000 |
LAMMPS Vashishta potential for the Si-O system developed by Vashishta et al. (1990) v000 |
view |
SNAP_ZuoChenLi_2019_Si__MO_869330304805_000 |
A spectral neighbor analysis potential for Si developed by Yunxing Zuo v000 |
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SNAP_ZuoChenLi_2019quadratic_Si__MO_721469752060_000 |
A quadratic spectral neighbor analysis potential for Si developed by Yunxing Zuo v000 |
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SW_BalamaneHaliciogluTiller_1992_Si__MO_113686039439_004 |
Stillinger-Weber potential for Si developed by Balamane, Halicioglu and Tiller (1992) v004 |
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SW_BalamaneHaliciogluTiller_1992_Si__MO_113686039439_005 |
Stillinger-Weber potential for Si developed by Balamane, Halicioglu and Tiller (1992) v005 |
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SW_BalamaneHauchShi_2017Brittle_Si__MO_381114941873_002 |
Stillinger-Weber potential for brittle Si combining the modifications of Balamane et al. (1992) and Hauch et al. (1999) v002 |
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SW_BalamaneHauchShi_2017Brittle_Si__MO_381114941873_003 |
Stillinger-Weber potential for brittle Si combining the modifications of Balamane et al. (1992) and Hauch et al. (1999) v003 |
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SW_HauchHollandMarder_1999Brittle_Si__MO_119167353542_004 |
Stillinger-Weber potential for brittle Si due to Hauch et al. (1999) v004 |
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SW_HauchHollandMarder_1999Brittle_Si__MO_119167353542_005 |
Stillinger-Weber potential for brittle Si due to Hauch et al. (1999) v005 |
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SW_LeeHwang_2012GGA_Si__MO_040570764911_000 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); GGA parameterization v000 |
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SW_LeeHwang_2012GGA_Si__MO_040570764911_001 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); GGA parameterization v001 |
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SW_LeeHwang_2012LDA_Si__MO_517338295712_000 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); LDA parameterization v000 |
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SW_LeeHwang_2012LDA_Si__MO_517338295712_001 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); LDA parameterization v001 |
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SW_StillingerWeber_1985_Si__MO_405512056662_005 |
Stillinger-Weber potential for Si due to Stillinger and Weber (1985) v005 |
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SW_StillingerWeber_1985_Si__MO_405512056662_006 |
Stillinger-Weber potential for Si due to Stillinger and Weber (1985) v006 |
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SW_ZhangXieHu_2014OptimizedSW1_Si__MO_800412945727_004 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW1' v004 |
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SW_ZhangXieHu_2014OptimizedSW1_Si__MO_800412945727_005 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW1' v005 |
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SW_ZhangXieHu_2014OptimizedSW2_Si__MO_475612090600_004 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW2' v004 |
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SW_ZhangXieHu_2014OptimizedSW2_Si__MO_475612090600_005 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW2' v005 |
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Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_003 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v003 |
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Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_004 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v004 |
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Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_005 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v005 |
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Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_002 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v002 |
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Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_003 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v003 |
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Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_004 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v004 |
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Tersoff_LAMMPS_MunetohMotookaMoriguchi_2007_SiO__MO_501246546792_000 |
Tersoff-style three-body potential for SiO developed by Munetoh et al. (2007) v000 |
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Tersoff_LAMMPS_PlummerTucker_2019_TiSiC__MO_751442731010_000 |
Tersoff-style three-body potential for TiSiC developed by Plummer and Tucker (2019) v000 |
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Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_002 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v002 |
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Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_003 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v003 |
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Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_004 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v004 |
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Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_002 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v002 |
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Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_003 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v003 |
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Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_004 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v004 |
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Tersoff_LAMMPS_Tersoff_1989_SiC__MO_171585019474_002 |
Tersoff-style three-body potential for SiC developed by Tersoff (1989) v002 |
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Tersoff_LAMMPS_Tersoff_1989_SiC__MO_171585019474_003 |
Tersoff-style three-body potential for SiC developed by Tersoff (1989) v003 |
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Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_002 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v002 |
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Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_003 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v003 |
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Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_004 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v004 |
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Tersoff_LAMMPS_Tersoff_1990_SiC__MO_444207127575_000 |
Tersoff-style three-body potential for SiC developed by Tersoff (1990) v000 |
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Tersoff_LAMMPS_Tersoff_1994_SiC__MO_794973922560_000 |
Tersoff-style three-body potential for SiC developed by Tersoff (1994) v000 |
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ThreeBodyBondOrder_KDS_KhorDasSarma_1988_Si__MO_722489435928_000 |
Three-body cluster potential for Si by Khor and Das Sarma (1988) v000 |
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ThreeBodyBondOrder_PPM_PurjaPunMishin_2017_Si__MO_566683736730_000 |
Three-body bond-order potential for Si by Purja Pun and Mishin (2017) v000 |
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ThreeBodyBondOrder_WR_WangRockett_1991_Si__MO_081872846741_000 |
Three-body bond-order potential for Si by Wang and Rockett (1991) v000 |
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ThreeBodyCluster_BH_BiswasHamann_1987_Si__MO_019616213550_000 |
Three-body cluster potential for Si by Biswas and Hamann (1987) v000 |
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ThreeBodyCluster_Gong_Gong_1993_Si__MO_407755720412_000 |
Three-body cluster potential for Si by Gong (1993) v000 |
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ThreeBodyCluster_KP_KaxirasPandey_1988_Si__MO_072486242437_000 |
Three-body cluster potential for Si by Kaxiras and Pandey (1988) v000 |
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ThreeBodyCluster_SRS_StephensonRadnySmith_1996_Si__MO_604248666067_000 |
Three-body cluster potential for Si by Stephenson, Radny and Smith (1996) v000 |
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TorchML_MACE_GuptaTadmorMartiniani_2024_Si__MO_781946209112_000 |
Parallel MACE Equivariant GNN for Si developed by Gupta et al. (2024) v000 |
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TorchML_NequIP_GuptaTadmorMartiniani_2024_Si__MO_196181738937_000 |
Parallel NequIP Equivariant GNN for Si developed by Gupta et al. (2024) v000 |
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Model |
Model Title |
Test Result |
EDIP_BOP_Bazant_Kaxiras_Si__MO_958932894036_001 |
Original EDIP potential for elemental silicon. |
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Four_Body_Mistriotis_Flytzanis_Farantos_Si__MO_080526771943_000 |
A four-body Mistriotis-Flytzanis-Farantos Model for Silicon |
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LennardJones612_UniversalShifted__MO_959249795837_002 |
Efficient "universal" shifted Lennard-Jones model for all KIM API supported species |
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Tersoff_LAMMPS_Erhart_Albe_CSi__MO_903987585848_001 |
Tersoff-style three-body potential for SiC by Erhart/Albe |
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Tersoff_LAMMPS_Erhart_Albe_CSi__MO_903987585848_002 |
Tersoff-style three-body potential for SiC by Erhart/Albe |
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Tersoff_LAMMPS_Erhart_Albe_SiII_CSi__MO_408791041969_000 |
Tersoff-style three-body potential for SiC by Erhart/Albe, parameter set Si II |
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Tersoff_LAMMPS_Erhart_Albe_SiII_CSi__MO_408791041969_001 |
Tersoff-style three-body potential for SiC by Erhart/Albe, parameter set Si II |
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Tersoff_LAMMPS_Tersoff_PRB37_1988_Si__MO_245095684871_000 |
Tersoff's silicon potential (PRB 37, 1988) |
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Tersoff_LAMMPS_Tersoff_PRB37_1988_Si__MO_245095684871_001 |
Tersoff's silicon potential (PRB 37, 1988) |
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Tersoff_LAMMPS_Tersoff_PRB38_1988_Si__MO_186459956893_000 |
Tersoff's silicon potential (PRB 38, 1988) |
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Tersoff_LAMMPS_Tersoff_PRB38_1988_Si__MO_186459956893_001 |
Tersoff's silicon potential (PRB 38, 1988) |
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Tersoff_LAMMPS_Tersoff_PRB39_1989_CSi__MO_171585019474_000 |
Tersoff's silicon carbide potential (PRB 39, 1989) |
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Tersoff_LAMMPS_Tersoff_PRB39_1989_CSi__MO_171585019474_001 |
Tersoff's silicon carbide potential (PRB 39, 1989) |
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Tersoff_LAMMPS_Tersoff_PRB39_1989_GeSi__MO_350526375143_000 |
Tersoff's silicon germanium potential (PRB 39, 1989) |
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Tersoff_LAMMPS_Tersoff_PRB39_1989_GeSi__MO_350526375143_001 |
Tersoff's silicon germanium potential (PRB 39, 1989) |
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Three_Body_Stillinger_Weber_Balamane_Hauch_Brittle_Si__MO_381114941873_000 |
Three Body Stillinger Weber Combined Balamane and Hauch Brittle Silicon |
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Three_Body_Stillinger_Weber_Balamane_Hauch_Brittle_Si__MO_381114941873_001 |
Three Body Stillinger Weber Combined Balamane and Hauch Brittle Silicon |
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Three_Body_Stillinger_Weber_Balamane_Si__MO_113686039439_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Balamane et al |
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Three_Body_Stillinger_Weber_Balamane_Si__MO_113686039439_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Balamane et al |
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Three_Body_Stillinger_Weber_Hauch_Brittle_Si__MO_119167353542_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Hauch et al |
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Three_Body_Stillinger_Weber_Hauch_Brittle_Si__MO_119167353542_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Hauch et al |
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Three_Body_Stillinger_Weber_Si__MO_405512056662_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon |
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Three_Body_Stillinger_Weber_Si__MO_405512056662_004 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon |
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Three_Body_Stillinger_Weber_Zhang_Silicene_Model1_Si__MO_800412945727_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
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Three_Body_Stillinger_Weber_Zhang_Silicene_Model1_Si__MO_800412945727_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
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Three_Body_Stillinger_Weber_Zhang_Silicene_Model2_Si__MO_475612090600_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
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Three_Body_Stillinger_Weber_Zhang_Silicene_Model2_Si__MO_475612090600_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
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Model |
Model Title |
Test Result |
EDIP_JustoBazantKaxiras_1998_Si__MO_958932894036_002 |
EDIP model for Si developed by Justo et al. (1998) v002 |
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EDIP_LAMMPS_JiangMorganSzlufarska_2012_SiC__MO_667792548433_000 |
EDIP model for SiC developed by Jiang, Morgan, and Szlufarska (2012) v000 |
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EDIP_LAMMPS_JustoBazantKaxiras_1998_Si__MO_315965276297_000 |
EDIP model for Si developed by Justo et al. (1998) v000 |
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EDIP_LAMMPS_LucasBertolusPizzagalli_2009_SiC__MO_634310164305_000 |
EDIP potential for Si-C developed by Lucas, Bertolus, and Pizzagalli (2009) v000 |
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LJ_ElliottAkerson_2015_Universal__MO_959249795837_003 |
Efficient 'universal' shifted Lennard-Jones model for all KIM API supported species developed by Elliott and Akerson (2015) v003 |
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MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_000 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v000 |
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MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_001 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v001 |
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MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_002 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v002 |
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MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_000 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v000 |
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MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_001 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v001 |
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MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_002 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v002 |
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MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_000 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v000 |
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MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_001 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v001 |
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MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_002 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v002 |
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MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_000 |
MEAM potential for Si developed by Huang et al. (2018) v000 |
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MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_001 |
MEAM potential for Si developed by Huang et al. (2018) v001 |
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MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_002 |
MEAM potential for Si developed by Huang et al. (2018) v002 |
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MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_000 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v000 |
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MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_001 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v001 |
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MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_002 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v002 |
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MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_000 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v000 |
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MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_001 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v001 |
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MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_002 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v002 |
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MEAM_LAMMPS_Lee_2007_Si__MO_774917820956_000 |
MEAM Potential for Si developed by Lee (2007) v000 |
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MEAM_LAMMPS_Lee_2007_Si__MO_774917820956_001 |
MEAM Potential for Si developed by Lee (2007) v001 |
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MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_000 |
MEAM potential for Si system developed by Lenosky et al. (2000) v000 |
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MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_001 |
MEAM potential for Si system developed by Lenosky et al. (2000) v001 |
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MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_002 |
MEAM potential for Si system developed by Lenosky et al. (2000) v002 |
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MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_000 |
MEAM potential for Si-C developed by Wagner (2007) v000 |
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MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_001 |
MEAM potential for Si-C developed by Wagner (2007) v001 |
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MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_002 |
MEAM potential for Si-C developed by Wagner (2007) v002 |
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MFF_MistriotisFlytzanisFarantos_1989_Si__MO_080526771943_001 |
MFF potential for Si developed by Mistriotis, Flytzanis and Farantos (1989) v001 |
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Sim_LAMMPS_ADP_StarikovGordeevLysogorskiy_2020_SiAuAl__SM_113843830602_000 |
LAMMPS ADP potential for the Si-Au-Al system developed by Starikov et al. (2020) v000 |
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Sim_LAMMPS_ADP_StarikovLopanitsynaSmirnova_2018_SiAu__SM_985135773293_000 |
LAMMPS ADP potential for the Si-Au system developed by Starikov et al. (2018) v000 |
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Sim_LAMMPS_EDIP_LucasBertolusPizzagalli_2009_SiC__SM_435704953434_000 |
LAMMPS EDIP potential for Si-C developed by Lucas, Bertolus, and Pizzagalli (2009) v000 |
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Sim_LAMMPS_GW_GaoWeber_2002_SiC__SM_606253546840_000 |
LAMMPS Gao-Weber potential for Si-C developed by Gao and Weber (2002) v000 |
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Sim_LAMMPS_GWZBL_Samolyuk_2016_SiC__SM_720598599889_000 |
LAMMPS Gao-Weber potential combined with a modified repulsive ZBL core function for the Si-C system developed by German Samolyuk (2016) v000 |
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Sim_LAMMPS_MEAM_CuiGaoCui_2012_LiSi__SM_562938628131_000 |
LAMMPS MEAM potential for Li-Si alloys developed by Cui et al. (2012) v000 |
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Sim_LAMMPS_MEAM_DuLenoskyHennig_2011_Si__SM_662785656123_000 |
LAMMPS Spline-based MEAM potential for Si system developed by Du et al. (2011) v000 |
view |
Sim_LAMMPS_MEAM_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__SM_656517352485_000 |
LAMMPS MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v000 |
view |
Sim_LAMMPS_MEAM_LenoskySadighAlonso_2000_Si__SM_622320990752_000 |
LAMMPS MEAM potential for Si system developed by Lenosky et al. (2000) v000 |
view |
Sim_LAMMPS_MEAM_Wagner_2007_SiC__SM_264944083668_000 |
LAMMPS MEAM potential for Si-C developed by Wagner (2007) v000 |
view |
Sim_LAMMPS_ModifiedTersoff_KumagaiIzumiHara_2007_Si__SM_773333226968_000 |
LAMMPS Modified Tersoff potential for Si by Kumagai et al. (2007) v000 |
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Sim_LAMMPS_ModifiedTersoff_PurjaPunMishin_2017_Si__SM_184524061456_000 |
LAMMPS Modified Tersoff potential for Si developed by Purja Pun and Mishin (2017) v000 |
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Sim_LAMMPS_ReaxFF_BrugnoliMiyataniAkaji_SiCeNaClHO_2023__SM_282799919035_000 |
LAMMPS ReaxFF potential for Ceria/Silica/Water/NaCl developed by Brugnoli et al. (2023) v000 |
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Sim_LAMMPS_ReaxFF_ManzanoMoeiniMarinelli_2012_CaSiOH__SM_714124634215_000 |
LAMMPS ReaxFF potential for Ca-Si-O-H systems developed by Manzano et al. (2012) v000 |
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Sim_LAMMPS_TersoffZBL_DevanathanDiazdelaRubiaWeber_1998_SiC__SM_578912636995_000 |
LAMMPS Tersoff-ZBL potential for Si-C developed by Devanathan, Diaz de la Rubia, and Weber (1998) v000 |
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Sim_LAMMPS_Vashishta_BroughtonMeliVashishta_1997_SiO__SM_422553794879_000 |
LAMMPS Vashishta potential for the Si-O system developed by Broughton et al. (1997) v000 |
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Sim_LAMMPS_Vashishta_NakanoKaliaVashishta_1994_SiO__SM_503555646986_000 |
LAMMPS Vashishta potential for the Si-O system developed by Nakano et al. (1994) v000 |
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Sim_LAMMPS_Vashishta_VashishtaKaliaNakano_2007_SiC__SM_196548226654_000 |
LAMMPS Vashishta potential for the Si-C system developed by Vashishta et al. (2007) v000 |
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Sim_LAMMPS_Vashishta_VashishtaKaliaRino_1990_SiO__SM_887826436433_000 |
LAMMPS Vashishta potential for the Si-O system developed by Vashishta et al. (1990) v000 |
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SNAP_ZuoChenLi_2019_Si__MO_869330304805_000 |
A spectral neighbor analysis potential for Si developed by Yunxing Zuo v000 |
view |
SNAP_ZuoChenLi_2019quadratic_Si__MO_721469752060_000 |
A quadratic spectral neighbor analysis potential for Si developed by Yunxing Zuo v000 |
view |
SW_BalamaneHaliciogluTiller_1992_Si__MO_113686039439_004 |
Stillinger-Weber potential for Si developed by Balamane, Halicioglu and Tiller (1992) v004 |
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SW_BalamaneHaliciogluTiller_1992_Si__MO_113686039439_005 |
Stillinger-Weber potential for Si developed by Balamane, Halicioglu and Tiller (1992) v005 |
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SW_BalamaneHauchShi_2017Brittle_Si__MO_381114941873_002 |
Stillinger-Weber potential for brittle Si combining the modifications of Balamane et al. (1992) and Hauch et al. (1999) v002 |
view |
SW_BalamaneHauchShi_2017Brittle_Si__MO_381114941873_003 |
Stillinger-Weber potential for brittle Si combining the modifications of Balamane et al. (1992) and Hauch et al. (1999) v003 |
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SW_HauchHollandMarder_1999Brittle_Si__MO_119167353542_004 |
Stillinger-Weber potential for brittle Si due to Hauch et al. (1999) v004 |
view |
SW_HauchHollandMarder_1999Brittle_Si__MO_119167353542_005 |
Stillinger-Weber potential for brittle Si due to Hauch et al. (1999) v005 |
view |
SW_LeeHwang_2012GGA_Si__MO_040570764911_000 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); GGA parameterization v000 |
view |
SW_LeeHwang_2012GGA_Si__MO_040570764911_001 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); GGA parameterization v001 |
view |
SW_LeeHwang_2012LDA_Si__MO_517338295712_000 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); LDA parameterization v000 |
view |
SW_LeeHwang_2012LDA_Si__MO_517338295712_001 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); LDA parameterization v001 |
view |
SW_StillingerWeber_1985_Si__MO_405512056662_005 |
Stillinger-Weber potential for Si due to Stillinger and Weber (1985) v005 |
view |
SW_StillingerWeber_1985_Si__MO_405512056662_006 |
Stillinger-Weber potential for Si due to Stillinger and Weber (1985) v006 |
view |
SW_ZhangXieHu_2014OptimizedSW1_Si__MO_800412945727_004 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW1' v004 |
view |
SW_ZhangXieHu_2014OptimizedSW1_Si__MO_800412945727_005 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW1' v005 |
view |
SW_ZhangXieHu_2014OptimizedSW2_Si__MO_475612090600_004 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW2' v004 |
view |
SW_ZhangXieHu_2014OptimizedSW2_Si__MO_475612090600_005 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW2' v005 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_003 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v003 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_004 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v004 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_005 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v005 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_002 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v002 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_003 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v003 |
view |
Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_004 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v004 |
view |
Tersoff_LAMMPS_MunetohMotookaMoriguchi_2007_SiO__MO_501246546792_000 |
Tersoff-style three-body potential for SiO developed by Munetoh et al. (2007) v000 |
view |
Tersoff_LAMMPS_PlummerTucker_2019_TiSiC__MO_751442731010_000 |
Tersoff-style three-body potential for TiSiC developed by Plummer and Tucker (2019) v000 |
view |
Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_002 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v002 |
view |
Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_003 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v003 |
view |
Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_004 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v004 |
view |
Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_002 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v002 |
view |
Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_003 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v003 |
view |
Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_004 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v004 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiC__MO_171585019474_002 |
Tersoff-style three-body potential for SiC developed by Tersoff (1989) v002 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiC__MO_171585019474_003 |
Tersoff-style three-body potential for SiC developed by Tersoff (1989) v003 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_002 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v002 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_003 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v003 |
view |
Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_004 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v004 |
view |
Tersoff_LAMMPS_Tersoff_1990_SiC__MO_444207127575_000 |
Tersoff-style three-body potential for SiC developed by Tersoff (1990) v000 |
view |
Tersoff_LAMMPS_Tersoff_1994_SiC__MO_794973922560_000 |
Tersoff-style three-body potential for SiC developed by Tersoff (1994) v000 |
view |
ThreeBodyBondOrder_KDS_KhorDasSarma_1988_Si__MO_722489435928_000 |
Three-body cluster potential for Si by Khor and Das Sarma (1988) v000 |
view |
ThreeBodyBondOrder_PPM_PurjaPunMishin_2017_Si__MO_566683736730_000 |
Three-body bond-order potential for Si by Purja Pun and Mishin (2017) v000 |
view |
ThreeBodyBondOrder_WR_WangRockett_1991_Si__MO_081872846741_000 |
Three-body bond-order potential for Si by Wang and Rockett (1991) v000 |
view |
ThreeBodyCluster_BH_BiswasHamann_1987_Si__MO_019616213550_000 |
Three-body cluster potential for Si by Biswas and Hamann (1987) v000 |
view |
ThreeBodyCluster_Gong_Gong_1993_Si__MO_407755720412_000 |
Three-body cluster potential for Si by Gong (1993) v000 |
view |
ThreeBodyCluster_KP_KaxirasPandey_1988_Si__MO_072486242437_000 |
Three-body cluster potential for Si by Kaxiras and Pandey (1988) v000 |
view |
ThreeBodyCluster_SRS_StephensonRadnySmith_1996_Si__MO_604248666067_000 |
Three-body cluster potential for Si by Stephenson, Radny and Smith (1996) v000 |
view |
TorchML_NequIP_GuptaTadmorMartiniani_2024_Si__MO_196181738937_000 |
Parallel NequIP Equivariant GNN for Si developed by Gupta et al. (2024) v000 |
view |
Model |
Model Title |
Test Result |
EDIP_BOP_Bazant_Kaxiras_Si__MO_958932894036_001 |
Original EDIP potential for elemental silicon. |
view |
Four_Body_Mistriotis_Flytzanis_Farantos_Si__MO_080526771943_000 |
A four-body Mistriotis-Flytzanis-Farantos Model for Silicon |
view |
LennardJones612_UniversalShifted__MO_959249795837_002 |
Efficient "universal" shifted Lennard-Jones model for all KIM API supported species |
view |
Tersoff_LAMMPS_Erhart_Albe_CSi__MO_903987585848_001 |
Tersoff-style three-body potential for SiC by Erhart/Albe |
view |
Tersoff_LAMMPS_Erhart_Albe_CSi__MO_903987585848_002 |
Tersoff-style three-body potential for SiC by Erhart/Albe |
view |
Tersoff_LAMMPS_Erhart_Albe_SiII_CSi__MO_408791041969_000 |
Tersoff-style three-body potential for SiC by Erhart/Albe, parameter set Si II |
view |
Tersoff_LAMMPS_Erhart_Albe_SiII_CSi__MO_408791041969_001 |
Tersoff-style three-body potential for SiC by Erhart/Albe, parameter set Si II |
view |
Tersoff_LAMMPS_Tersoff_PRB37_1988_Si__MO_245095684871_000 |
Tersoff's silicon potential (PRB 37, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB37_1988_Si__MO_245095684871_001 |
Tersoff's silicon potential (PRB 37, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB38_1988_Si__MO_186459956893_000 |
Tersoff's silicon potential (PRB 38, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB38_1988_Si__MO_186459956893_001 |
Tersoff's silicon potential (PRB 38, 1988) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_CSi__MO_171585019474_000 |
Tersoff's silicon carbide potential (PRB 39, 1989) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_CSi__MO_171585019474_001 |
Tersoff's silicon carbide potential (PRB 39, 1989) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_GeSi__MO_350526375143_000 |
Tersoff's silicon germanium potential (PRB 39, 1989) |
view |
Tersoff_LAMMPS_Tersoff_PRB39_1989_GeSi__MO_350526375143_001 |
Tersoff's silicon germanium potential (PRB 39, 1989) |
view |
Three_Body_Stillinger_Weber_Balamane_Hauch_Brittle_Si__MO_381114941873_000 |
Three Body Stillinger Weber Combined Balamane and Hauch Brittle Silicon |
view |
Three_Body_Stillinger_Weber_Balamane_Hauch_Brittle_Si__MO_381114941873_001 |
Three Body Stillinger Weber Combined Balamane and Hauch Brittle Silicon |
view |
Three_Body_Stillinger_Weber_Balamane_Si__MO_113686039439_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Balamane et al |
view |
Three_Body_Stillinger_Weber_Balamane_Si__MO_113686039439_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Balamane et al |
view |
Three_Body_Stillinger_Weber_Hauch_Brittle_Si__MO_119167353542_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Hauch et al |
view |
Three_Body_Stillinger_Weber_Hauch_Brittle_Si__MO_119167353542_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Hauch et al |
view |
Three_Body_Stillinger_Weber_Si__MO_405512056662_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon |
view |
Three_Body_Stillinger_Weber_Si__MO_405512056662_004 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model1_Si__MO_800412945727_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model1_Si__MO_800412945727_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model2_Si__MO_475612090600_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model2_Si__MO_475612090600_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Model |
Model Title |
Test Result |
EDIP_JustoBazantKaxiras_1998_Si__MO_958932894036_002 |
EDIP model for Si developed by Justo et al. (1998) v002 |
view |
EDIP_LAMMPS_JiangMorganSzlufarska_2012_SiC__MO_667792548433_000 |
EDIP model for SiC developed by Jiang, Morgan, and Szlufarska (2012) v000 |
view |
EDIP_LAMMPS_JustoBazantKaxiras_1998_Si__MO_315965276297_000 |
EDIP model for Si developed by Justo et al. (1998) v000 |
view |
EDIP_LAMMPS_LucasBertolusPizzagalli_2009_SiC__MO_634310164305_000 |
EDIP potential for Si-C developed by Lucas, Bertolus, and Pizzagalli (2009) v000 |
view |
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003 |
Efficient 'universal' shifted Lennard-Jones model for all KIM API supported species developed by Elliott and Akerson (2015) v003 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_000 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v000 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_001 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v001 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_002 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v002 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_000 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v000 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_001 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v001 |
view |
MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_002 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v002 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_000 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v000 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_001 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v001 |
view |
MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_002 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v002 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_000 |
MEAM potential for Si developed by Huang et al. (2018) v000 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_001 |
MEAM potential for Si developed by Huang et al. (2018) v001 |
view |
MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_002 |
MEAM potential for Si developed by Huang et al. (2018) v002 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_000 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v000 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_001 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v001 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_002 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v002 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_000 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v000 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_001 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v001 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_002 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v002 |
view |
MEAM_LAMMPS_Lee_2007_Si__MO_774917820956_000 |
MEAM Potential for Si developed by Lee (2007) v000 |
view |
MEAM_LAMMPS_Lee_2007_Si__MO_774917820956_001 |
MEAM Potential for Si developed by Lee (2007) v001 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_000 |
MEAM potential for Si system developed by Lenosky et al. (2000) v000 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_001 |
MEAM potential for Si system developed by Lenosky et al. (2000) v001 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_002 |
MEAM potential for Si system developed by Lenosky et al. (2000) v002 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_000 |
MEAM potential for Si-C developed by Wagner (2007) v000 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_001 |
MEAM potential for Si-C developed by Wagner (2007) v001 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_002 |
MEAM potential for Si-C developed by Wagner (2007) v002 |
view |
MFF_MistriotisFlytzanisFarantos_1989_Si__MO_080526771943_001 |
MFF potential for Si developed by Mistriotis, Flytzanis and Farantos (1989) v001 |
view |
Sim_LAMMPS_ADP_StarikovGordeevLysogorskiy_2020_SiAuAl__SM_113843830602_000 |
LAMMPS ADP potential for the Si-Au-Al system developed by Starikov et al. (2020) v000 |
view |
Sim_LAMMPS_ADP_StarikovLopanitsynaSmirnova_2018_SiAu__SM_985135773293_000 |
LAMMPS ADP potential for the Si-Au system developed by Starikov et al. (2018) v000 |
view |
Sim_LAMMPS_EDIP_LucasBertolusPizzagalli_2009_SiC__SM_435704953434_000 |
LAMMPS EDIP potential for Si-C developed by Lucas, Bertolus, and Pizzagalli (2009) v000 |
view |
Sim_LAMMPS_GW_GaoWeber_2002_SiC__SM_606253546840_000 |
LAMMPS Gao-Weber potential for Si-C developed by Gao and Weber (2002) v000 |
view |
Sim_LAMMPS_GWZBL_Samolyuk_2016_SiC__SM_720598599889_000 |
LAMMPS Gao-Weber potential combined with a modified repulsive ZBL core function for the Si-C system developed by German Samolyuk (2016) v000 |
view |
Sim_LAMMPS_MEAM_CuiGaoCui_2012_LiSi__SM_562938628131_000 |
LAMMPS MEAM potential for Li-Si alloys developed by Cui et al. (2012) v000 |
view |
Sim_LAMMPS_MEAM_DuLenoskyHennig_2011_Si__SM_662785656123_000 |
LAMMPS Spline-based MEAM potential for Si system developed by Du et al. (2011) v000 |
view |
Sim_LAMMPS_MEAM_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__SM_656517352485_000 |
LAMMPS MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v000 |
view |
Sim_LAMMPS_MEAM_LenoskySadighAlonso_2000_Si__SM_622320990752_000 |
LAMMPS MEAM potential for Si system developed by Lenosky et al. (2000) v000 |
view |
Sim_LAMMPS_MEAM_Wagner_2007_SiC__SM_264944083668_000 |
LAMMPS MEAM potential for Si-C developed by Wagner (2007) v000 |
view |
Sim_LAMMPS_ModifiedTersoff_KumagaiIzumiHara_2007_Si__SM_773333226968_000 |
LAMMPS Modified Tersoff potential for Si by Kumagai et al. (2007) v000 |
view |
Sim_LAMMPS_ModifiedTersoff_PurjaPunMishin_2017_Si__SM_184524061456_000 |
LAMMPS Modified Tersoff potential for Si developed by Purja Pun and Mishin (2017) v000 |
view |
Sim_LAMMPS_ReaxFF_BrugnoliMiyataniAkaji_SiCeNaClHO_2023__SM_282799919035_000 |
LAMMPS ReaxFF potential for Ceria/Silica/Water/NaCl developed by Brugnoli et al. (2023) v000 |
view |
Sim_LAMMPS_ReaxFF_ManzanoMoeiniMarinelli_2012_CaSiOH__SM_714124634215_000 |
LAMMPS ReaxFF potential for Ca-Si-O-H systems developed by Manzano et al. (2012) v000 |
view |
Sim_LAMMPS_TersoffZBL_DevanathanDiazdelaRubiaWeber_1998_SiC__SM_578912636995_000 |
LAMMPS Tersoff-ZBL potential for Si-C developed by Devanathan, Diaz de la Rubia, and Weber (1998) v000 |
view |
Sim_LAMMPS_Vashishta_BroughtonMeliVashishta_1997_SiO__SM_422553794879_000 |
LAMMPS Vashishta potential for the Si-O system developed by Broughton et al. (1997) v000 |
view |
Sim_LAMMPS_Vashishta_NakanoKaliaVashishta_1994_SiO__SM_503555646986_000 |
LAMMPS Vashishta potential for the Si-O system developed by Nakano et al. (1994) v000 |
view |
Sim_LAMMPS_Vashishta_VashishtaKaliaNakano_2007_SiC__SM_196548226654_000 |
LAMMPS Vashishta potential for the Si-C system developed by Vashishta et al. (2007) v000 |
view |
Sim_LAMMPS_Vashishta_VashishtaKaliaRino_1990_SiO__SM_887826436433_000 |
LAMMPS Vashishta potential for the Si-O system developed by Vashishta et al. (1990) v000 |
view |
SNAP_ZuoChenLi_2019_Si__MO_869330304805_000 |
A spectral neighbor analysis potential for Si developed by Yunxing Zuo v000 |
view |
SNAP_ZuoChenLi_2019quadratic_Si__MO_721469752060_000 |
A quadratic spectral neighbor analysis potential for Si developed by Yunxing Zuo v000 |
view |
SW_BalamaneHaliciogluTiller_1992_Si__MO_113686039439_004 |
Stillinger-Weber potential for Si developed by Balamane, Halicioglu and Tiller (1992) v004 |
view |
SW_BalamaneHaliciogluTiller_1992_Si__MO_113686039439_005 |
Stillinger-Weber potential for Si developed by Balamane, Halicioglu and Tiller (1992) v005 |
view |
SW_BalamaneHauchShi_2017Brittle_Si__MO_381114941873_002 |
Stillinger-Weber potential for brittle Si combining the modifications of Balamane et al. (1992) and Hauch et al. (1999) v002 |
view |
SW_BalamaneHauchShi_2017Brittle_Si__MO_381114941873_003 |
Stillinger-Weber potential for brittle Si combining the modifications of Balamane et al. (1992) and Hauch et al. (1999) v003 |
view |
SW_HauchHollandMarder_1999Brittle_Si__MO_119167353542_004 |
Stillinger-Weber potential for brittle Si due to Hauch et al. (1999) v004 |
view |
SW_HauchHollandMarder_1999Brittle_Si__MO_119167353542_005 |
Stillinger-Weber potential for brittle Si due to Hauch et al. (1999) v005 |
view |
SW_LeeHwang_2012GGA_Si__MO_040570764911_000 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); GGA parameterization v000 |
view |
SW_LeeHwang_2012GGA_Si__MO_040570764911_001 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); GGA parameterization v001 |
view |
SW_LeeHwang_2012LDA_Si__MO_517338295712_000 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); LDA parameterization v000 |
view |
SW_LeeHwang_2012LDA_Si__MO_517338295712_001 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); LDA parameterization v001 |
view |
SW_StillingerWeber_1985_Si__MO_405512056662_005 |
Stillinger-Weber potential for Si due to Stillinger and Weber (1985) v005 |
view |
SW_StillingerWeber_1985_Si__MO_405512056662_006 |
Stillinger-Weber potential for Si due to Stillinger and Weber (1985) v006 |
view |
SW_ZhangXieHu_2014OptimizedSW1_Si__MO_800412945727_004 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW1' v004 |
view |
SW_ZhangXieHu_2014OptimizedSW1_Si__MO_800412945727_005 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW1' v005 |
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SW_ZhangXieHu_2014OptimizedSW2_Si__MO_475612090600_004 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW2' v004 |
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SW_ZhangXieHu_2014OptimizedSW2_Si__MO_475612090600_005 |
Stillinger-Weber potential for Si optimized for silicene developed by Zhang et al. (2014); Parameterization 'Optimized SW2' v005 |
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Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_003 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v003 |
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Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_004 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v004 |
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Tersoff_LAMMPS_ErhartAlbe_2005_SiC__MO_903987585848_005 |
Tersoff-style three-body potential for SiC developed by Erhart and Albe (2005) v005 |
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Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_002 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v002 |
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Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_003 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v003 |
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Tersoff_LAMMPS_ErhartAlbe_2005SiII_SiC__MO_408791041969_004 |
Tersoff-style three-body potential for SiC (with SiII parameter set) developed by Erhart and Albe (2005) v004 |
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Tersoff_LAMMPS_MunetohMotookaMoriguchi_2007_SiO__MO_501246546792_000 |
Tersoff-style three-body potential for SiO developed by Munetoh et al. (2007) v000 |
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Tersoff_LAMMPS_PlummerTucker_2019_TiSiC__MO_751442731010_000 |
Tersoff-style three-body potential for TiSiC developed by Plummer and Tucker (2019) v000 |
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Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_002 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v002 |
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Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_003 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v003 |
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Tersoff_LAMMPS_Tersoff_1988T2_Si__MO_245095684871_004 |
Tersoff T2 potential for silicon developed by Tersoff (1988) v004 |
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Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_002 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v002 |
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Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_003 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v003 |
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Tersoff_LAMMPS_Tersoff_1988T3_Si__MO_186459956893_004 |
Tersoff T3 potential for silicon developed by Tersoff (1988) v004 |
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Tersoff_LAMMPS_Tersoff_1989_SiC__MO_171585019474_002 |
Tersoff-style three-body potential for SiC developed by Tersoff (1989) v002 |
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Tersoff_LAMMPS_Tersoff_1989_SiC__MO_171585019474_003 |
Tersoff-style three-body potential for SiC developed by Tersoff (1989) v003 |
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Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_002 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v002 |
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Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_003 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v003 |
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Tersoff_LAMMPS_Tersoff_1989_SiGe__MO_350526375143_004 |
Tersoff-style three-body potential for SiGe developed by Tersoff (1989) v004 |
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Tersoff_LAMMPS_Tersoff_1990_SiC__MO_444207127575_000 |
Tersoff-style three-body potential for SiC developed by Tersoff (1990) v000 |
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Tersoff_LAMMPS_Tersoff_1994_SiC__MO_794973922560_000 |
Tersoff-style three-body potential for SiC developed by Tersoff (1994) v000 |
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ThreeBodyBondOrder_KDS_KhorDasSarma_1988_Si__MO_722489435928_000 |
Three-body cluster potential for Si by Khor and Das Sarma (1988) v000 |
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ThreeBodyBondOrder_PPM_PurjaPunMishin_2017_Si__MO_566683736730_000 |
Three-body bond-order potential for Si by Purja Pun and Mishin (2017) v000 |
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ThreeBodyBondOrder_WR_WangRockett_1991_Si__MO_081872846741_000 |
Three-body bond-order potential for Si by Wang and Rockett (1991) v000 |
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ThreeBodyCluster_BH_BiswasHamann_1987_Si__MO_019616213550_000 |
Three-body cluster potential for Si by Biswas and Hamann (1987) v000 |
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ThreeBodyCluster_Gong_Gong_1993_Si__MO_407755720412_000 |
Three-body cluster potential for Si by Gong (1993) v000 |
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ThreeBodyCluster_KP_KaxirasPandey_1988_Si__MO_072486242437_000 |
Three-body cluster potential for Si by Kaxiras and Pandey (1988) v000 |
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ThreeBodyCluster_SRS_StephensonRadnySmith_1996_Si__MO_604248666067_000 |
Three-body cluster potential for Si by Stephenson, Radny and Smith (1996) v000 |
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TorchML_MACE_GuptaTadmorMartiniani_2024_Si__MO_781946209112_000 |
Parallel MACE Equivariant GNN for Si developed by Gupta et al. (2024) v000 |
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TorchML_NequIP_GuptaTadmorMartiniani_2024_Si__MO_196181738937_000 |
Parallel NequIP Equivariant GNN for Si developed by Gupta et al. (2024) v000 |
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Model |
Model Title |
Test Result |
EDIP_BOP_Bazant_Kaxiras_Si__MO_958932894036_001 |
Original EDIP potential for elemental silicon. |
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Four_Body_Mistriotis_Flytzanis_Farantos_Si__MO_080526771943_000 |
A four-body Mistriotis-Flytzanis-Farantos Model for Silicon |
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LennardJones612_UniversalShifted__MO_959249795837_002 |
Efficient "universal" shifted Lennard-Jones model for all KIM API supported species |
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Tersoff_LAMMPS_Erhart_Albe_CSi__MO_903987585848_001 |
Tersoff-style three-body potential for SiC by Erhart/Albe |
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Tersoff_LAMMPS_Erhart_Albe_CSi__MO_903987585848_002 |
Tersoff-style three-body potential for SiC by Erhart/Albe |
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Tersoff_LAMMPS_Erhart_Albe_SiII_CSi__MO_408791041969_000 |
Tersoff-style three-body potential for SiC by Erhart/Albe, parameter set Si II |
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Tersoff_LAMMPS_Erhart_Albe_SiII_CSi__MO_408791041969_001 |
Tersoff-style three-body potential for SiC by Erhart/Albe, parameter set Si II |
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Tersoff_LAMMPS_Tersoff_PRB37_1988_Si__MO_245095684871_000 |
Tersoff's silicon potential (PRB 37, 1988) |
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Tersoff_LAMMPS_Tersoff_PRB37_1988_Si__MO_245095684871_001 |
Tersoff's silicon potential (PRB 37, 1988) |
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Tersoff_LAMMPS_Tersoff_PRB38_1988_Si__MO_186459956893_000 |
Tersoff's silicon potential (PRB 38, 1988) |
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Tersoff_LAMMPS_Tersoff_PRB38_1988_Si__MO_186459956893_001 |
Tersoff's silicon potential (PRB 38, 1988) |
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Tersoff_LAMMPS_Tersoff_PRB39_1989_CSi__MO_171585019474_000 |
Tersoff's silicon carbide potential (PRB 39, 1989) |
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Tersoff_LAMMPS_Tersoff_PRB39_1989_CSi__MO_171585019474_001 |
Tersoff's silicon carbide potential (PRB 39, 1989) |
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Tersoff_LAMMPS_Tersoff_PRB39_1989_GeSi__MO_350526375143_000 |
Tersoff's silicon germanium potential (PRB 39, 1989) |
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Tersoff_LAMMPS_Tersoff_PRB39_1989_GeSi__MO_350526375143_001 |
Tersoff's silicon germanium potential (PRB 39, 1989) |
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Three_Body_Stillinger_Weber_Balamane_Hauch_Brittle_Si__MO_381114941873_000 |
Three Body Stillinger Weber Combined Balamane and Hauch Brittle Silicon |
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Three_Body_Stillinger_Weber_Balamane_Hauch_Brittle_Si__MO_381114941873_001 |
Three Body Stillinger Weber Combined Balamane and Hauch Brittle Silicon |
view |
Three_Body_Stillinger_Weber_Balamane_Si__MO_113686039439_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Balamane et al |
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Three_Body_Stillinger_Weber_Balamane_Si__MO_113686039439_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Balamane et al |
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Three_Body_Stillinger_Weber_Hauch_Brittle_Si__MO_119167353542_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Hauch et al |
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Three_Body_Stillinger_Weber_Hauch_Brittle_Si__MO_119167353542_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon modified by Hauch et al |
view |
Three_Body_Stillinger_Weber_Si__MO_405512056662_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon |
view |
Three_Body_Stillinger_Weber_Si__MO_405512056662_004 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model1_Si__MO_800412945727_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model1_Si__MO_800412945727_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model2_Si__MO_475612090600_002 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Three_Body_Stillinger_Weber_Zhang_Silicene_Model2_Si__MO_475612090600_003 |
A three-body Stillinger-Weber (SW) Model (Parameterization) for Silicon Optimized for Silicene |
view |
Model |
Model Title |
Test Result |
EDIP_JustoBazantKaxiras_1998_Si__MO_958932894036_002 |
EDIP model for Si developed by Justo et al. (1998) v002 |
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EDIP_LAMMPS_JiangMorganSzlufarska_2012_SiC__MO_667792548433_000 |
EDIP model for SiC developed by Jiang, Morgan, and Szlufarska (2012) v000 |
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EDIP_LAMMPS_JustoBazantKaxiras_1998_Si__MO_315965276297_000 |
EDIP model for Si developed by Justo et al. (1998) v000 |
view |
EDIP_LAMMPS_LucasBertolusPizzagalli_2009_SiC__MO_634310164305_000 |
EDIP potential for Si-C developed by Lucas, Bertolus, and Pizzagalli (2009) v000 |
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LJ_ElliottAkerson_2015_Universal__MO_959249795837_003 |
Efficient 'universal' shifted Lennard-Jones model for all KIM API supported species developed by Elliott and Akerson (2015) v003 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_000 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v000 |
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MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_001 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v001 |
view |
MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_002 |
MEAM Potential for the Fe-Mn-Si-C system developed by Aslam et al. (2019) v002 |
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MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_000 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v000 |
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MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_001 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v001 |
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MEAM_LAMMPS_CuiGaoCui_2012_LiSi__MO_557492625287_002 |
MEAM potential for Li-Si alloys developed by Cui et al. (2012) v002 |
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MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_000 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v000 |
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MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_001 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v001 |
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MEAM_LAMMPS_DuLenoskyHennig_2011_Si__MO_883726743759_002 |
Spline-based MEAM potential for Si system developed by Du et al. (2011) v002 |
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MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_000 |
MEAM potential for Si developed by Huang et al. (2018) v000 |
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MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_001 |
MEAM potential for Si developed by Huang et al. (2018) v001 |
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MEAM_LAMMPS_HuangDongLiu_2018_Si__MO_050147023220_002 |
MEAM potential for Si developed by Huang et al. (2018) v002 |
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MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_000 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v000 |
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MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_001 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v001 |
view |
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_002 |
MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v002 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_000 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v000 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_001 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v001 |
view |
MEAM_LAMMPS_KangEunJun_2014_SiC__MO_477506997611_002 |
MEAM Potential for the Si-C system developed by Kang et al. (2014) v002 |
view |
MEAM_LAMMPS_Lee_2007_Si__MO_774917820956_000 |
MEAM Potential for Si developed by Lee (2007) v000 |
view |
MEAM_LAMMPS_Lee_2007_Si__MO_774917820956_001 |
MEAM Potential for Si developed by Lee (2007) v001 |
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MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_000 |
MEAM potential for Si system developed by Lenosky et al. (2000) v000 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_001 |
MEAM potential for Si system developed by Lenosky et al. (2000) v001 |
view |
MEAM_LAMMPS_LenoskySadighAlonso_2000_Si__MO_533426548156_002 |
MEAM potential for Si system developed by Lenosky et al. (2000) v002 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_000 |
MEAM potential for Si-C developed by Wagner (2007) v000 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_001 |
MEAM potential for Si-C developed by Wagner (2007) v001 |
view |
MEAM_LAMMPS_Wagner_2007_SiC__MO_430846853065_002 |
MEAM potential for Si-C developed by Wagner (2007) v002 |
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MFF_MistriotisFlytzanisFarantos_1989_Si__MO_080526771943_001 |
MFF potential for Si developed by Mistriotis, Flytzanis and Farantos (1989) v001 |
view |
Sim_LAMMPS_ADP_StarikovGordeevLysogorskiy_2020_SiAuAl__SM_113843830602_000 |
LAMMPS ADP potential for the Si-Au-Al system developed by Starikov et al. (2020) v000 |
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Sim_LAMMPS_ADP_StarikovLopanitsynaSmirnova_2018_SiAu__SM_985135773293_000 |
LAMMPS ADP potential for the Si-Au system developed by Starikov et al. (2018) v000 |
view |
Sim_LAMMPS_EDIP_LucasBertolusPizzagalli_2009_SiC__SM_435704953434_000 |
LAMMPS EDIP potential for Si-C developed by Lucas, Bertolus, and Pizzagalli (2009) v000 |
view |
Sim_LAMMPS_GW_GaoWeber_2002_SiC__SM_606253546840_000 |
LAMMPS Gao-Weber potential for Si-C developed by Gao and Weber (2002) v000 |
view |
Sim_LAMMPS_GWZBL_Samolyuk_2016_SiC__SM_720598599889_000 |
LAMMPS Gao-Weber potential combined with a modified repulsive ZBL core function for the Si-C system developed by German Samolyuk (2016) v000 |
view |
Sim_LAMMPS_MEAM_CuiGaoCui_2012_LiSi__SM_562938628131_000 |
LAMMPS MEAM potential for Li-Si alloys developed by Cui et al. (2012) v000 |
view |
Sim_LAMMPS_MEAM_DuLenoskyHennig_2011_Si__SM_662785656123_000 |
LAMMPS Spline-based MEAM potential for Si system developed by Du et al. (2011) v000 |
view |
Sim_LAMMPS_MEAM_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__SM_656517352485_000 |
LAMMPS MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v000 |
view |
Sim_LAMMPS_MEAM_LenoskySadighAlonso_2000_Si__SM_622320990752_000 |
LAMMPS MEAM potential for Si system developed by Lenosky et al. (2000) v000 |
view |
Sim_LAMMPS_MEAM_Wagner_2007_SiC__SM_264944083668_000 |
LAMMPS MEAM potential for Si-C developed by Wagner (2007) v000 |
view |
Sim_LAMMPS_ModifiedTersoff_KumagaiIzumiHara_2007_Si__SM_773333226968_000 |
LAMMPS Modified Tersoff potential for Si by Kumagai et al. (2007) v000 |
view |
Sim_LAMMPS_ModifiedTersoff_PurjaPunMishin_2017_Si__SM_184524061456_000 |
LAMMPS Modified Tersoff potential for Si developed by Purja Pun and Mishin (2017) v000 |
view |
Sim_LAMMPS_ReaxFF_BrugnoliMiyataniAkaji_SiCeNaClHO_2023__SM_282799919035_000 |
LAMMPS ReaxFF potential for Ceria/Silica/Water/NaCl developed by Brugnoli et al. (2023) v000 |
view |
Sim_LAMMPS_ReaxFF_ManzanoMoeiniMarinelli_2012_CaSiOH__SM_714124634215_000 |
LAMMPS ReaxFF potential for Ca-Si-O-H systems developed by Manzano et al. (2012) v000 |
view |
Sim_LAMMPS_TersoffZBL_DevanathanDiazdelaRubiaWeber_1998_SiC__SM_578912636995_000 |
LAMMPS Tersoff-ZBL potential for Si-C developed by Devanathan, Diaz de la Rubia, and Weber (1998) v000 |
view |
Sim_LAMMPS_Vashishta_BroughtonMeliVashishta_1997_SiO__SM_422553794879_000 |
LAMMPS Vashishta potential for the Si-O system developed by Broughton et al. (1997) v000 |
view |
Sim_LAMMPS_Vashishta_NakanoKaliaVashishta_1994_SiO__SM_503555646986_000 |
LAMMPS Vashishta potential for the Si-O system developed by Nakano et al. (1994) v000 |
view |
Sim_LAMMPS_Vashishta_VashishtaKaliaNakano_2007_SiC__SM_196548226654_000 |
LAMMPS Vashishta potential for the Si-C system developed by Vashishta et al. (2007) v000 |
view |
Sim_LAMMPS_Vashishta_VashishtaKaliaRino_1990_SiO__SM_887826436433_000 |
LAMMPS Vashishta potential for the Si-O system developed by Vashishta et al. (1990) v000 |
view |
SNAP_ZuoChenLi_2019_Si__MO_869330304805_000 |
A spectral neighbor analysis potential for Si developed by Yunxing Zuo v000 |
view |
SNAP_ZuoChenLi_2019quadratic_Si__MO_721469752060_000 |
A quadratic spectral neighbor analysis potential for Si developed by Yunxing Zuo v000 |
view |
SW_BalamaneHaliciogluTiller_1992_Si__MO_113686039439_004 |
Stillinger-Weber potential for Si developed by Balamane, Halicioglu and Tiller (1992) v004 |
view |
SW_BalamaneHaliciogluTiller_1992_Si__MO_113686039439_005 |
Stillinger-Weber potential for Si developed by Balamane, Halicioglu and Tiller (1992) v005 |
view |
SW_BalamaneHauchShi_2017Brittle_Si__MO_381114941873_002 |
Stillinger-Weber potential for brittle Si combining the modifications of Balamane et al. (1992) and Hauch et al. (1999) v002 |
view |
SW_BalamaneHauchShi_2017Brittle_Si__MO_381114941873_003 |
Stillinger-Weber potential for brittle Si combining the modifications of Balamane et al. (1992) and Hauch et al. (1999) v003 |
view |
SW_HauchHollandMarder_1999Brittle_Si__MO_119167353542_004 |
Stillinger-Weber potential for brittle Si due to Hauch et al. (1999) v004 |
view |
SW_HauchHollandMarder_1999Brittle_Si__MO_119167353542_005 |
Stillinger-Weber potential for brittle Si due to Hauch et al. (1999) v005 |
view |
SW_LeeHwang_2012GGA_Si__MO_040570764911_000 |
Stillinger-Weber potential for Si optimized for thermal conductivity due to Lee and Hwang (1985); GGA parameterization v000 |
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