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UnitConversion__VC_128739598203_000

Title
A single sentence description.
Verification check of unit conversion v000
Description This verification check ensures that a model can properly convert units of length and energy. Working in one unit system, a random cluster of atoms is generated based on the smallest cutoff of the model such that the energy and/or forces (depending on what the model actually reports) are sizeable. Next, the model is reinitialized with a different set of registered units. The coordinates of the atoms in the cluster are rescaled to correspond to the new length units and the energy and/or forces are requested from the model once again. The energy and/or force returned by the model are then compared to a manual conversion of those originally returned (in the first set of units).
Disclaimer
A statement of applicability provided by the contributor, informing users of the intended use of this KIM Item.
None
Contributor Daniel S. Karls
Maintainer Daniel S. Karls
Published on KIM 2019
How to Cite Click here to download this citation in BibTeX format.
Funding Not available
Short KIM ID
The unique KIM identifier code.
VC_128739598203_000
Extended KIM ID
The long form of the KIM ID including a human readable prefix (100 characters max), two underscores, and the Short KIM ID. Extended KIM IDs can only contain alpha-numeric characters (letters and digits) and underscores and must begin with a letter.
UnitConversion__VC_128739598203_000
DOI 10.25950/79265377
https://doi.org/10.25950/79265377
https://search.datacite.org/works/10.25950/79265377
KIM Item TypeVerification Check
Properties
Properties as defined in kimspec.edn.
KIM API Version2.0
Simulator Name
The name of the simulator as defined in kimspec.edn.
none
Programming Language(s)
The programming languages used in the code and the percentage of the code written in each one.
100.00% Python


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Model Error Categories Link to Error page
Dipole_Umeno_YSZ__MO_394669891912_001 mismatch view
EAM_Dynamo_CaiYe_1996_AlCu__MO_942551040047_005 other view
EAM_Dynamo_Mishin_2004_NiAl__MO_101214310689_005 other view
EAM_Dynamo_MishinMehlPapaconstantopoulos_2002_NiAl__MO_109933561507_005 other view
EAM_NN_Johnson_1988_Cu__MO_887933271505_002 other view
MEAM_2NN_Fe_to_Ga__MO_145522277939_001 mismatch view
MEAM_2NN_GaInN__MO_117938381510_001 mismatch view
MEAM_2NN_LiSi__MO_596436139350_001 mismatch view
model_ArCHHeXe_BOP_AIREBO__MO_154399806462_001 mismatch view
Morse_Shifted_GirifalcoWeizer_1959LowCutoff_Fe__MO_331285495617_002 other view
MSMEAM_Gibson_Ti__MO_309653492217_000 mismatch view
Pair_Morse_Modified_MacDonaldMacDonald_Cu__MO_034823476734_000 mismatch view
Sim_LAMMPS_ADP_ApostolMishin_2011_AlCu__SM_667696763561_000 mismatch view
Sim_LAMMPS_ADP_HowellsMishin_2018_Cr__SM_884076133432_000 mismatch view
Sim_LAMMPS_ADP_MishinMehlPapaconstantopoulos_2005_Ni__SM_477692857359_000 mismatch view
Sim_LAMMPS_ADP_PunDarlingKecskes_2015_CuTa__SM_399364650444_000 mismatch view
Sim_LAMMPS_ADP_SmirnovaStarikov_2017_ZrNb__SM_937902197407_000 mismatch view
Sim_LAMMPS_ADP_StarikovGordeevLysogorskiy_2020_SiAuAl__SM_113843830602_000 mismatch view
Sim_LAMMPS_ADP_StarikovKolotovaKuksin_2017_UMo__SM_682749584055_000 mismatch view
Sim_LAMMPS_ADP_StarikovLopanitsynaSmirnova_2018_SiAu__SM_985135773293_000 mismatch view
Sim_LAMMPS_ADP_TseplyaevStarikova_2016_UN__SM_474015477315_000 mismatch view
Sim_LAMMPS_AGNI_BotuBatraChapman_2017_Al__SM_666183636896_000 mismatch view
Sim_LAMMPS_AIREBO_LJ_StuartTuteinHarrison_2000_CH__SM_069621990420_000 mismatch view
Sim_LAMMPS_AIREBO_Morse_OConnorAndzelmRobbins_2015_CH__SM_460187474631_000 mismatch view
Sim_LAMMPS_BOP_MurdickZhouWadley_2006_GaAs__SM_104202807866_000 mismatch view
Sim_LAMMPS_BOP_WardZhouWong_2012_CdTe__SM_509819366101_000 mismatch view
Sim_LAMMPS_BOP_WardZhouWong_2012_CdZnTe__SM_409035133405_000 mismatch view
Sim_LAMMPS_BOP_WardZhouWong_2013_CdZnTe__SM_010061267051_000 mismatch view
Sim_LAMMPS_BOP_ZhouFosterVanSwol_2014_CdTeSe__SM_567065323363_000 mismatch view
Sim_LAMMPS_BOP_ZhouWardFoster_2015_CCu__SM_784926969362_000 mismatch view
Sim_LAMMPS_BOP_ZhouWardFoster_2015_CuH__SM_404135993060_000 mismatch view
Sim_LAMMPS_BOP_ZhouWardFoster_2016_AlCu__SM_566399258279_000 mismatch view
Sim_LAMMPS_Buckingham_ArimaYamasakiTorikai_2005_CeO__SM_328512278696_000 mismatch view
Sim_LAMMPS_Buckingham_CarreHorbachIspas_2008_SiO__SM_886641404623_000 mismatch view
Sim_LAMMPS_Buckingham_FangKeltyHe_2014_LaO__SM_576027677976_000 mismatch view
Sim_LAMMPS_Buckingham_FisherMatsubara_2005_NiO__SM_337243826931_000 mismatch view
Sim_LAMMPS_Buckingham_MatsuiAkaogi_1991_TiO__SM_690504433912_000 mismatch view
Sim_LAMMPS_Buckingham_SayleCatlowMaphanga_2005_MnO__SM_757974494010_000 mismatch view
Sim_LAMMPS_Buckingham_SunStirnerHagston_2006_AlO__SM_466046725502_000 mismatch view
Sim_LAMMPS_Buckingham_SunStirnerHagston_2006_MgO__SM_152356670345_000 mismatch view
Sim_LAMMPS_Buckingham_Vaari_2015_FeO__SM_672759489721_000 mismatch view
Sim_LAMMPS_Buckingham_WangShinShin_2019_CrO__SM_295921111679_000 mismatch view
Sim_LAMMPS_EAM_BonnyCastinBullens_2013_FeCrW__SM_699257350704_000 mismatch view
Sim_LAMMPS_EAM_BonnyPasianotTerentyev_2011_FeCr__SM_237089298463_000 mismatch view
Sim_LAMMPS_EAMCD_StukowskiSadighErhart_2009_FeCr__SM_775564499513_000 mismatch view
Sim_LAMMPS_EDIP_JiangMorganSzlufarska_2012_SiC__SM_435704953434_000 mismatch view
Sim_LAMMPS_EIM_Zhou_2010_BrClCsFIKLiNaRb__SM_259779394709_000 mismatch view
Sim_LAMMPS_GW_GaoWeber_2002_SiC__SM_606253546840_000 mismatch view
Sim_LAMMPS_GWZBL_Samolyuk_2016_SiC__SM_720598599889_000 mismatch view
Sim_LAMMPS_LCBOP_LosFasolino_2003_C__SM_469631949122_000 mismatch view
Sim_LAMMPS_MEAM_AlmyrasSangiovanniSarakinos_2019_NAlTi__SM_871795249052_000 mismatch view
Sim_LAMMPS_MEAM_AsadiZaeemNouranian_2015_Cu__SM_239791545509_000 mismatch view
Sim_LAMMPS_MEAM_AsadiZaeemNouranian_2015_Fe__SM_042630680993_000 mismatch view
Sim_LAMMPS_MEAM_AsadiZaeemNouranian_2015_Ni__SM_078420412697_000 mismatch view
Sim_LAMMPS_MEAM_CuiGaoCui_2012_LiSi__SM_562938628131_000 mismatch view
Sim_LAMMPS_MEAM_DuLenoskyHennig_2011_Si__SM_662785656123_000 mismatch view
Sim_LAMMPS_MEAM_EtesamiAsadi_2018_Cu__SM_316120381362_000 mismatch view
Sim_LAMMPS_MEAM_EtesamiAsadi_2018_Fe__SM_267016608755_000 mismatch view
Sim_LAMMPS_MEAM_EtesamiAsadi_2018_Ni__SM_333792531460_000 mismatch view
Sim_LAMMPS_MEAM_FernandezPascuet_2014_U__SM_176800861722_000 mismatch view
Sim_LAMMPS_MEAM_GaoOterodelaRozaAouadi_2013_AgTaO__SM_485325656366_000 mismatch view
Sim_LAMMPS_MEAM_HennigLenoskyTrinkle_2008_Ti__SM_318953488749_000 mismatch view
Sim_LAMMPS_MEAM_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__SM_656517352485_000 mismatch view
Sim_LAMMPS_MEAM_KimJungLee_2009_FeTiC__SM_531038274471_000 mismatch view
Sim_LAMMPS_MEAM_KoGrabowskiNeugebauer_2015_NiTi__SM_770142935022_000 mismatch view
Sim_LAMMPS_MEAM_Lenosky_2017_W__SM_631352869360_000 mismatch view
Sim_LAMMPS_MEAM_LenoskySadighAlonso_2000_Si__SM_622320990752_000 mismatch view
Sim_LAMMPS_MEAM_LiyanageSeongGonHouze_2014_FeC__SM_652425777808_000 mismatch view
Sim_LAMMPS_MEAM_MaiselKoZhang_2017_VNiTi__SM_971529344487_000 mismatch view
Sim_LAMMPS_MEAM_ParkFellingerLenosky_2012_Mo__SM_769176993156_000 mismatch view
Sim_LAMMPS_MEAM_ParkFellingerLenosky_2012_Ta__SM_907764821792_000 mismatch view
Sim_LAMMPS_MEAM_ParkFellingerLenosky_2012_W__SM_163270462402_000 mismatch view
Sim_LAMMPS_MEAM_PascuetFernandez_2015_Al__SM_811588957187_000 mismatch view
Sim_LAMMPS_MEAM_PascuetFernandez_2015_AlU__SM_721930391003_000 mismatch view
Sim_LAMMPS_MEAM_VellaChenStillinger_2017_Sn__SM_629915663723_000 mismatch view
Sim_LAMMPS_MEAM_Wagner_2007_Cu__SM_521856783904_000 mismatch view
Sim_LAMMPS_MEAM_Wagner_2007_Ni__SM_168413969663_000 mismatch view
Sim_LAMMPS_MEAM_Wagner_2007_SiC__SM_264944083668_000 mismatch view
Sim_LAMMPS_MEAM_ZhangTrinkle_2016_TiO__SM_513612626462_000 mismatch view
Sim_LAMMPS_ModifiedTersoff_ByggmastarHodilleFerro_2018_BeO__SM_305223021383_000 mismatch view
Sim_LAMMPS_ModifiedTersoff_KumagaiIzumiHara_2007_Si__SM_773333226968_000 mismatch view
Sim_LAMMPS_ModifiedTersoff_PurjaPunMishin_2017_Si__SM_184524061456_000 mismatch view
Sim_LAMMPS_Polymorphic_BereSerra_2006_GaN__SM_518345582208_000 mismatch view
Sim_LAMMPS_Polymorphic_NordAlbeErhart_2003_GaN__SM_333071728528_000 mismatch view
Sim_LAMMPS_Polymorphic_Zhou_2004_CuTa__SM_453737875254_000 mismatch view
Sim_LAMMPS_ReaxFF_AryanpourVanDuinKubicki_2010_FeHO__SM_222964216001_001 mismatch view
Sim_LAMMPS_ReaxFF_ChenowethVanDuinGoddard_2008_CHO__SM_584143153761_001 mismatch view
Sim_LAMMPS_ReaxFF_ChenowethVanDuinPersson_2008_CHOV__SM_429148913211_001 mismatch view
Sim_LAMMPS_ReaxFF_KeithFantauzziJacob_2010_AuO__SM_974345878378_001 mismatch view
Sim_LAMMPS_ReaxFF_RaymandVanDuinBaudin_2008_ZnOH__SM_449472104549_001 mismatch view
Sim_LAMMPS_ReaxFF_SinghSrinivasanNeekAmal_2013_CFH__SM_306840588959_000 mismatch view
Sim_LAMMPS_ReaxFF_StrachanVanDuinChakraborty_2003_CHNO__SM_107643900657_001 mismatch view
Sim_LAMMPS_ReaxFF_WeismillerVanDuinLee_2010_BHNO__SM_327381922729_001 mismatch view
Sim_LAMMPS_SMTBQ_SallesPolitanoAmzallag_2016_Al__SM_404097633924_000 mismatch view
Sim_LAMMPS_SMTBQ_SallesPolitanoAmzallag_2016_AlO__SM_853967355976_000 mismatch view
Sim_LAMMPS_SMTBQ_SallesPolitanoAmzallag_2016_TiO__SM_349577644423_000 mismatch view
Sim_LAMMPS_SNAP_ChenDengTran_2017_Mo__SM_003882782678_000 mismatch view
Sim_LAMMPS_TersoffZBL_ByggmastarGranberg_2020_Fe__SM_958863895234_000 mismatch view
Sim_LAMMPS_TersoffZBL_DevanathanDiazdelaRubiaWeber_1998_SiC__SM_578912636995_000 mismatch view
Sim_LAMMPS_TersoffZBL_HenrikssonBjorkasNordlund_2013_FeC__SM_473463498269_000 mismatch view
Sim_LAMMPS_Vashishta_BranicioRinoGan_2009_InP__SM_090647175366_000 mismatch view
Sim_LAMMPS_Vashishta_BroughtonMeliVashishta_1997_SiO__SM_422553794879_000 mismatch view
Sim_LAMMPS_Vashishta_NakanoKaliaVashishta_1994_SiO__SM_503555646986_000 mismatch view
Sim_LAMMPS_Vashishta_VashishtaKaliaNakano_2007_SiC__SM_196548226654_000 mismatch view
Sim_LAMMPS_Vashishta_VashishtaKaliaRino_1990_SiO__SM_887826436433_000 mismatch view