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StackingFaultFccCrystal_Cu_0bar__TE_090810770014_001

Title
A single sentence description.
Stacking and twinning fault energies for fcc Cu
Description Intrinsic and extrinsic stacking fault energies, unstable stacking fault energy, unstable twinning energy, stacking fault energy as a function of fractional displacement, and gamma surface for fcc Cu at zero temperature and pressure.
Species
The supported atomic species.
Cu
Contributor SubrahmanyamPattamatta
Maintainer SubrahmanyamPattamatta
Author Subrahmanyam Pattamatta
Publication Year 2018
Source Citations
A citation to primary published work(s) that describe this KIM Item.

Bernstein N, Tadmor EB (2004) Tight-binding calculations of stacking energies and twinnability in fcc metals. Physical Review B 69(9):094116. doi:10.1103/PhysRevB.69.094116

Item Citation Click here to download a citation in BibTeX format.
Short KIM ID
The unique KIM identifier code.
TE_090810770014_001
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.
StackingFaultFccCrystal_Cu_0bar__TE_090810770014_001
Citable Link https://openkim.org/cite/TE_090810770014_001
KIM Item TypeTest
DriverStackingFaultFccCrystal__TD_228501831190_001
Properties
Properties as defined in kimspec.edn. These properties are inhereted from the Test Driver.
KIM API Version2.0
Simulator Name
The name of the simulator as defined in kimspec.edn. This Simulator Name is inhereted from the Test Driver.
lammps
Programming Language(s)
The programming languages used in the code and the percentage of the code written in each one.
100.00% Python
Previous Version StackingFaultFccCrystal_Cu_0bar__TE_090810770014_000


Models

No Driver
Model Test Results Link to Test Results page Benchmark time
Usertime muliplied by the Whetstone Benchmark. This number can be used (approximately) to compare the performance of different models independently of the architecture on which the test was run.

Measured in Millions of Whetstone Instructions (MWI)
Sim_LAMMPS_ADP_ApostolMishin_2011_AlCu__SM_667696763561_000 view 7494190
Sim_LAMMPS_ADP_PunDarlingKecskes_2015_CuTa__SM_399364650444_000 view 9190588
Sim_LAMMPS_BOP_ZhouWardFoster_2015_CCu__SM_784926969362_000 view 343927618
Sim_LAMMPS_BOP_ZhouWardFoster_2015_CuH__SM_404135993060_000 view 262320703
Sim_LAMMPS_BOP_ZhouWardFoster_2016_AlCu__SM_566399258279_000 view 298352191
Sim_LAMMPS_MEAM_AsadiZaeemNouranian_2015_Cu__SM_239791545509_000 view 8394399
Sim_LAMMPS_MEAM_EtesamiAsadi_2018_Cu__SM_316120381362_000 view 13872912
Sim_LAMMPS_MEAM_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__SM_656517352485_000 view 20815433
Sim_LAMMPS_MEAM_Wagner_2007_Cu__SM_521856783904_000 view 14836425
EAM_Dynamo__MD_120291908751_005
Model Test Results Link to Test Results page Benchmark time
Usertime muliplied by the Whetstone Benchmark. This number can be used (approximately) to compare the performance of different models independently of the architecture on which the test was run.

Measured in Millions of Whetstone Instructions (MWI)
EAM_Dynamo_AcklandTichyVitek_1987_Cu__MO_179025990738_005 view 3604718
EAM_Dynamo_AcklandTichyVitek_1987v2_Cu__MO_762798677854_000 view 3547927
EAM_Dynamo_AcklandVitek_1990_Cu__MO_642748370624_000 view 3562879
EAM_Dynamo_AdamsFoiles_1989Universal6_Cu__MO_145873824897_000 view 5248785
EAM_Dynamo_BonnyPasianotCastin_2009_FeCuNi__MO_469343973171_005 view 5811781
EAM_Dynamo_BorovikovMendelevKing_2016_CuZr__MO_097471813275_000 view 12374222
EAM_Dynamo_CaiYe_1996_AlCu__MO_942551040047_005 view 7139169
EAM_Dynamo_Foiles_1985_Cu__MO_831121933939_000 view 4990950
EAM_Dynamo_FoilesBaskesDaw_1986Universal3_Cu__MO_666348409573_004 view 5004394
EAM_Dynamo_HoytGarvinWebb_2003_PbCu__MO_119135752160_005 view 7462169
EAM_Dynamo_LiuLiuBorucki_1999_AlCu__MO_020851069572_000 view 5974484
EAM_Dynamo_MendelevKing_2008_Cu__MO_748636486270_005 view 7570231
EAM_Dynamo_MendelevKramerBecker_2008_Cu__MO_945691923444_005 view 7543151
EAM_Dynamo_MendelevKramerOtt_2009_CuZr__MO_600021860456_005 view 13822571
EAM_Dynamo_MendelevSordeletKramer_2007_CuZr__MO_120596890176_005 view 13852859
EAM_Dynamo_MishinMehlPapaconstantopoulos_2001_Cu__MO_346334655118_005 view 5972302
EAM_Dynamo_OnatDurukanoglu_2014_CuNi__MO_592013496703_005 view 9677542
EAM_Dynamo_WilliamsMishinHamilton_2006_CuAg__MO_128703483589_005 view 7756292
EAM_Dynamo_WuTrinkle_2009_CuAg__MO_270337113239_005 view 9363398
EAM_Dynamo_ZhouJohnsonWadley_2004_Cu__MO_127245782811_005 view 454227
EAM_Dynamo_ZhouJohnsonWadley_2004NISTretabulation_CuAgAu__MO_318213562153_000 view 8894187
EAM_Dynamo_ZhouWadleyJohnson_2001_Cu__MO_380822813353_000 view 20458808
EAM_Dynamo_ZhouWadleyJohnson_2001_CuTa__MO_547744193826_000 view 9392370
EAM_Dynamo_ZhouWadleyJohnson_2001NISTretabulation_Cu__MO_759493141826_000 view 462152
EAM_Dynamo_ZhouWadleyJohnson_2001NISTretabulation_CuTa__MO_950828638160_000 view 8736585
EMT_Asap__MD_128315414717_004
Model Test Results Link to Test Results page Benchmark time
Usertime muliplied by the Whetstone Benchmark. This number can be used (approximately) to compare the performance of different models independently of the architecture on which the test was run.

Measured in Millions of Whetstone Instructions (MWI)
EMT_Asap_MetalGlass_BaileySchiotzJacobsen_2004_CuMg__MO_228059236215_001 view 12317335
EMT_Asap_MetalGlass_PaduraruKenoufiBailey_2007_CuZr__MO_987541074959_001 view 14760319
EMT_Asap_Standard_JacobsenStoltzeNorskov_1996_AlAgAuCuNiPdPt__MO_115316750986_001 view 10499335
EMT_Asap_Standard_JacobsenStoltzeNorskov_1996_Cu__MO_396616545191_001 view 8542888
Morse_Shifted__MD_552566534109_002
Model Test Results Link to Test Results page Benchmark time
Usertime muliplied by the Whetstone Benchmark. This number can be used (approximately) to compare the performance of different models independently of the architecture on which the test was run.

Measured in Millions of Whetstone Instructions (MWI)
Morse_Shifted_GirifalcoWeizer_1959HighCutoff_Cu__MO_151002396060_002 view 26428575
Morse_Shifted_GirifalcoWeizer_1959LowCutoff_Cu__MO_673777079812_002 view 11706918
Morse_Shifted_GirifalcoWeizer_1959MedCutoff_Cu__MO_173787283511_002 view 20018537
No Driver
Model Test Results Link to Test Results page Benchmark time
Usertime muliplied by the Whetstone Benchmark. This number can be used (approximately) to compare the performance of different models independently of the architecture on which the test was run.

Measured in Millions of Whetstone Instructions (MWI)
EAM_NN_Johnson_1988_Cu__MO_887933271505_002 view 225654





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