Models - by Species




Models in the OpenKIM Repository

Each "model" is a specific parameterization of an interatomic model class for a given material system (e.g. the Lennard-Jones potential for Ar). Click for more information.

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Cu
ModelSimulator
"Any" means any KIM-compliant simulator, otherwise the model is a simulator model that only works with that specific simulator.
Title
EAM_Dynamo_AcklandTichyVitek_1987_Cu__MO_179025990738_005AnyFinnis-Sinclair potential (LAMMPS cubic hermite tabulation) for Cu developed by Ackland et al. (1987) v005
EAM_Dynamo_AcklandTichyVitek_1987v2_Cu__MO_762798677854_000AnyFinnis-Sinclair potential (LAMMPS cubic hermite tabulation) for Cu developed by Ackland et al. (1987), version 2 refitted for radiation studies v000
EAM_Dynamo_AcklandVitek_1990_Cu__MO_642748370624_000AnyFinnis-Sinclair potential (LAMMPS cubic hermite tabulation) for Cu developed by Ackland and Vitek (1990) v000
EAM_Dynamo_AdamsFoilesWolfer_1989Universal6_Cu__MO_145873824897_000AnyEAM potential (LAMMPS cubic hermite tabulation) for Cu (Universal6) developed by Adams, Foiles, and Wolfer (1989) v000
EAM_Dynamo_BonnyPasianotCastin_2009_FeCuNi__MO_469343973171_005AnyEAM potential (LAMMPS cubic hermite tabulation) for Fe-Cu-Ni reactor pressure vessel steels developed by Bonny et al. (2009) v005
EAM_Dynamo_BorovikovMendelevKing_2016_CuZr__MO_097471813275_000AnyFinnis-Sinclair potential (LAMMPS cubic hermite tabulation) for the Cu-Zr system developed by Borovikov, Mendelev and King (2016) v000
EAM_Dynamo_CaiYe_1996_AlCu__MO_942551040047_005AnyEAM potential (LAMMPS cubic hermite tabulation) for the Al-Cu system developed by Cai and Ye (1996) v005
EAM_Dynamo_DeluigiPasianotValencia_2021_FeNiCrCoCu__MO_657255834688_000AnyEAM potential (LAMMPS cubic hermite tabulation) for FeNiCrCoCu developed by Deluigi et al. (2021) v000
EAM_Dynamo_FarkasCaro_2018_FeNiCrCoCu__MO_803527979660_000AnyEAM potential (LAMMPS cubic hermite tabulation) for the Fe-Ni-Cr-Co-Cu system developed by Farkas and Caro (2018) v000
EAM_Dynamo_FischerSchmitzEich_2019_CuNi__MO_266134052596_000AnyEAM potential for Cu–Ni developed by Fischer et al. (2019) v000
EAM_Dynamo_Foiles_1985_Cu__MO_831121933939_000AnyEAM potential (LAMMPS cubic hermite tabulation) for Cu developed by Foiles (1985) for NiCu alloys v000
EAM_Dynamo_FoilesBaskesDaw_1986Universal3_Cu__MO_666348409573_004AnyEAM potential (LAMMPS cubic hermite tabulation) for Cu (Universal3) developed by Foiles, Baskes, and Daw (1986) v004
EAM_Dynamo_GolaPastewka_2018_CuAu__MO_426403318662_000AnyEAM potential (LAMMPS cubic hermite tabulation) for Cu-Au alloys developed by Gola and Pastewka (2018) v000
EAM_Dynamo_HoytGarvinWebb_2003_PbCu__MO_119135752160_005AnyEAM potential (LAMMPS cubic hermite tabulation) for the Pb-Cu system developed by Hoyt et al. (2003) v005
EAM_Dynamo_LiuLiuBorucki_1999_AlCu__MO_020851069572_000AnyEAM potential (LAMMPS cubic hermite tabulation) for the Al-Cu system developed by Liu et al. (1999) v000
EAM_Dynamo_MendelevKing_2013_Cu__MO_748636486270_005AnyFinnis-Sinclair potential (LAMMPS cubic hermite tabulation) for Cu with improved stacking fault energy developed by Mendelv and King (2013) v005
EAM_Dynamo_MendelevKramerBecker_2008_Cu__MO_945691923444_005AnyEAM potential (LAMMPS cubic hermite tabulation) for Cu solidification developed by Mendelev et al. (2008) v005
EAM_Dynamo_MendelevKramerOtt_2009_CuZr__MO_600021860456_005AnyFinnis-Sinclar potential (LAMMPS cubic hermite tabulation) for liquid and amorphous Cu-Zr alloys developed by Mendelev et al. (2009) v005
EAM_Dynamo_MendelevSordeletKramer_2007_CuZr__MO_120596890176_005AnyFinnis-Sinclair potential (LAMMPS cubic hermite tabulation) for the Cu-Zr system developed by Mendelev, Sordelet and Kramer (2007) v005
EAM_Dynamo_MendelevSunZhang_2019_CuZr__MO_609260676108_000AnyFinnis-Sinclair potential for the Cu-Zr system developed by Mendelev et al. (2019) v000
EAM_Dynamo_MishinMehlPapaconstantopoulos_2001_Cu__MO_346334655118_005AnyEAM potential (LAMMPS cubic hermite tabulation) for Cu developed by Mishin, Mehl and Papaconstantopoulos (2001) v005
EAM_Dynamo_OnatDurukanoglu_2014_CuNi__MO_592013496703_005AnyEAM potential (LAMMPS cubic hermite tabulation) for Cu-Ni alloys developed by Onat and Durukanoğlu (2014) v005
EAM_Dynamo_WilliamsMishinHamilton_2006_CuAg__MO_128703483589_005AnyEAM potential (LAMMPS cubic hermite tabulation) for the Cu-Ag system developed by Williams et al. (2006) v000
EAM_Dynamo_WuTrinkle_2009_CuAg__MO_270337113239_005AnyEAM potential (LAMMPS cubic hermite tabulation) for the Cu-Ag system developed by Wu and Trinkle (2009) v000
EAM_Dynamo_ZhouJohnsonWadley_2004_Cu__MO_127245782811_005AnyEAM potential (LAMMPS cubic hermite tabulation) for Cu developed by Zhou, Johnson and Wadley (2004) v005
EAM_Dynamo_ZhouJohnsonWadley_2004_CuAgAuNiPdPtAlPbFeMoTaWMgCoTiZr__MO_870117231765_000AnyEAM potential (LAMMPS cubic hermite tabulation) for the Cu-Ag-Au-Ni-Pd-Pt-Al-Pb-Fe-Mo-Ta-W-Mg-Co-Ti-Zr system developed by Zhou, Johnson, and Wadley (2004) v000
EAM_Dynamo_ZhouJohnsonWadley_2004_CuTa__MO_547744193826_000AnyEAM potential (LAMMPS cubic hermite tabulation) for the Cu-Ta system developed by Zhou, Johnson, and Wadley (2004) v000
EAM_Dynamo_ZhouJohnsonWadley_2004NISTretabulation_Cu__MO_759493141826_000AnyEAM potential (LAMMPS cubic hermite tabulation) for Cu developed by Zhou, Johnson, and Wadley (2004); NIST retabulation v000
EAM_Dynamo_ZhouJohnsonWadley_2004NISTretabulation_CuAgAu__MO_318213562153_000AnyEAM potential (LAMMPS cubic hermite tabulation) for the Cu-Ag-Au system developed by Zhou, Johnson and Wadley (2004); NIST retabulation v000
EAM_Dynamo_ZhouJohnsonWadley_2004NISTretabulation_CuTa__MO_950828638160_000AnyEAM potential (LAMMPS cubic hermite tabulation) for the Cu-Ta system developed by Zhou, Johnson, and Wadley (2004); NIST retabulation v000
EAM_Dynamo_ZhouWadleyJohnson_2001_Cu__MO_380822813353_000AnyEAM potential (LAMMPS cubic hermite tabulation) for Cu developed by Zhou, Wadley and Johnson (2001) v000
EAM_Mendelev_2019_CuZr__MO_945018740343_000AnyEAM potential for Cu-Zr developed by Mendelev (2019) v000
EAM_NN_Johnson_1988_Cu__MO_887933271505_003AnyEAM Potential (analytical nearest-neighbor) for Cu developed by Johnson (1988) v003
EMT_Asap_MetalGlass_BaileySchiotzJacobsen_2004_CuMg__MO_228059236215_001AnyEMT potential for Cu-Mg metallic glasses developed by Bailey, Schiotz, and Jacobsen (2004) v001
EMT_Asap_MetalGlass_CuMgZr__MO_655725647552_002AnyEffective Medium Theory potential for CuMg and CuZr alloys, in particular metallic glasses.
EMT_Asap_MetalGlass_PaduraruKenoufiBailey_2007_CuZr__MO_987541074959_001AnyEMT potential for Cu-Zr metallic glasses developed by Paduraru et al. (2007) v001
EMT_Asap_Standard_Jacobsen_Stoltze_Norskov_AlAgAuCuNiPdPt__MO_118428466217_002AnyStandard Effective Medium Theory potential for face-centered cubic metals as implemented in ASE/Asap.
EMT_Asap_Standard_JacobsenStoltzeNorskov_1996_AlAgAuCuNiPdPt__MO_115316750986_001AnyEMT potential for Al, Ni, Cu, Pd, Ag, Pt and Au developed by Jacobsen, Stoltze, and Norskov (1996) v001
EMT_Asap_Standard_JacobsenStoltzeNorskov_1996_Cu__MO_396616545191_001AnyEMT potential for Cu developed by Jacobsen, Stoltze, and Norskov (1996) v001
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003AnyEfficient 'universal' shifted Lennard-Jones model for all KIM API supported species developed by Elliott and Akerson (2015) v003
MEAM_2NN_Fe_to_Ga__MO_145522277939_001AnyModel parameterization of 2NN MEAM model
MEAM_LAMMPS_AgrawalMirzaeifar_2021_CuC__MO_028979335952_002AnyMEAM potential for Cu-C composites developed by Agrawal and Mirzaeifar (2021) v002
MEAM_LAMMPS_AsadiZaeemNouranian_2015_Cu__MO_390178379548_002AnyMEAM potential for Cu developed by Asadi et al. (2015) v002
MEAM_LAMMPS_EtesamiAsadi_2018_Cu__MO_227887284491_002AnyMEAM potential for Cu developed by Etesami and Asadi (2018) v002
MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_002AnyMEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v002
MEAM_LAMMPS_JeongParkDo_2018_PdCu__MO_353393547686_002AnyMEAM Potential for the Pd-Cu system developed by Jeong et al. (2018) v002
MEAM_LAMMPS_KangSaLee_2009_ZrAgCu__MO_813575892799_002AnyMEAM Potential for the Zr-Ag-Cu system developed by Kang et al. (2009) v002
MEAM_LAMMPS_KimLee_2008_CuZr__MO_407917731909_001AnyMEAM Potential for the Cu-Zr system developed by Kim and Lee (2008) v001
MEAM_LAMMPS_KimSeolJi_2017_PtCu__MO_070797404269_002AnyMEAM Potential for the Pt-Cu system developed by Kim and Lee (2017) v002
MEAM_LAMMPS_LeeShim_2004_NiCu__MO_409065472403_002AnyMEAM Potential for the Ni-Cu system developed by Lee and Shim (2004) v002
MEAM_LAMMPS_LeeShimBaskes_2003_Cu__MO_087820130586_001AnyMEAM Potential for Cu developed by Lee, Shim, and Baskes (2003) v001
MEAM_LAMMPS_LeeWirthShim_2005_FeCu__MO_063626065437_002AnyMEAM Potential for the Fe-Cu system developed by Lee et al. (2005) v002
MEAM_LAMMPS_MirazDhariwalMeng_2020_CuNTi__MO_122936827583_002AnyMEAM potential for Ti/TiN and Cu/TiN interfaces developed by Miraz et al. (2020) v002
MEAM_LAMMPS_Wagner_2007_Cu__MO_313717476091_002AnyMEAM potential for Cu developed by Wagner (2007) v002
MEAM_LAMMPS_WangOhLee_2020_CuCo__MO_694335101831_002AnyMEAM Potential for the Cu-Co system developed by Wang et al. (2020) v002
MEAM_LAMMPS_WangOhLee_2020_CuCo__MO_849011491644_002AnyMEAM Potential for the Cu-Co system developed by Wang, Oh, and Lee (2020) v002
MEAM_LAMMPS_WangOhLee_2020_CuMo__MO_380272712420_002AnyMEAM Potential for the Cu-Mo system developed by Wang, Oh, and Lee (2020) v002
MEAM_LAMMPS_WangOhLee_2020_CuMo__MO_486450342170_002AnyMEAM Potential for the Cu-Mo system developed by Wang et al. (2020) v002
Morse_Shifted_GirifalcoWeizer_1959HighCutoff_Cu__MO_151002396060_004AnyMorse potential (shifted) for Cu by Girifalco and Weizer (1959) using a high-accuracy cutoff distance v004
Morse_Shifted_GirifalcoWeizer_1959LowCutoff_Cu__MO_673777079812_004AnyMorse potential (shifted) for Cu by Girifalco and Weizer (1959) using a low-accuracy cutoff distance v004
Morse_Shifted_GirifalcoWeizer_1959MedCutoff_Cu__MO_173787283511_004AnyMorse potential (shifted) for Cu by Girifalco and Weizer (1959) using a medium-accuracy cutoff distance v004
Pair_Morse_Modified_MacDonaldMacDonald_Cu__MO_034823476734_000AnyModified Morse pair potential for copper due to MacDonald and MacDonald
Sim_ASAP_EMT_Rasmussen_AgAuCu__SM_847706399649_000ASAPASAP EMT potential optimized for experimental stacking fault energies developed by Rasmussen v000
Sim_LAMMPS_ADP_ApostolMishin_2011_AlCu__SM_667696763561_000LAMMPSLAMMPS ADP potential for Al-Cu developed by Apostol and Mishin (2011) v000
Sim_LAMMPS_ADP_PunDarlingKecskes_2015_CuTa__SM_399364650444_000LAMMPSLAMMPS ADP potential for the Cu-Ta system developed by Pun et al. (2015) v000
Sim_LAMMPS_BOP_ZhouWardFoster_2015_CCu__SM_784926969362_000LAMMPSLAMMPS BOP potential for the C-Cu system developed by Zhou, Ward, and Foster (2015) v000
Sim_LAMMPS_BOP_ZhouWardFoster_2015_CuH__SM_404135993060_000LAMMPSLAMMPS BOP potential for the Cu-H system developed by Zhou et al. (2015) v000
Sim_LAMMPS_BOP_ZhouWardFoster_2016_AlCu__SM_566399258279_001LAMMPSLAMMPS BOP potential for the Al-Cu system developed by Zhou, Ward, and Foster (2016) v001
Sim_LAMMPS_BOP_ZhouWardFoster_2018_AlCuH__SM_834012669168_000LAMMPSLAMMPS BOP potential for the Al-Cu-H system developed by Zhou, Ward and Foster (2018) v000
Sim_LAMMPS_IFF_CHARMM_GUI_HeinzLinMishra_2023_Nanomaterials__SM_232384752957_000LAMMPSInterface Force Field (IFF) parameters due to Heinz et al. as used in the CHARMM-GUI input generator v000
Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_001LAMMPSLAMMPS PCFF bonded force-field combined with IFF non-bonded 9-6 Lennard-Jones potentials for metal interactions v001
Sim_LAMMPS_MEAM_AsadiZaeemNouranian_2015_Cu__SM_239791545509_000LAMMPSLAMMPS MEAM potential for Cu developed by Asadi et al. (2015) v000
Sim_LAMMPS_MEAM_EtesamiAsadi_2018_Cu__SM_316120381362_001LAMMPSLAMMPS MEAM potential for Cu developed by Etesami and Asadi (2018) v001
Sim_LAMMPS_MEAM_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__SM_656517352485_000LAMMPSLAMMPS MEAM potential for Al-Si-Mg-Cu-Fe alloys developed by Jelinek et al. (2012) v000
Sim_LAMMPS_MEAM_Wagner_2007_Cu__SM_521856783904_000LAMMPSLAMMPS MEAM potential for Cu developed by Wagner (2007) v000
Sim_LAMMPS_Polymorphic_Zhou_2004_CuTa__SM_453737875254_000LAMMPSLAMMPS EAM potential for the Cu-Ta system developed by Zhou et al. (2004) and implemented using the polymorphic framework of Zhou et al. (2015) v000
SNAP_LiHuChen_2018_Cu__MO_529419924683_000AnyA spectral neighbor analysis potential for Cu developed by Xiangguo Li (2019) v000
SNAP_ZuoChenLi_2019_Cu__MO_931672895580_000AnyA spectral neighbor analysis potential for Cu developed by Yunxing Zuo v000
SNAP_ZuoChenLi_2019quadratic_Cu__MO_265210066873_000AnyA quadratic spectral neighbor analysis potential for Cu developed by Yunxing Zuo v000