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PhononDispersionCurve_fcc_Ni__TE_948896757313_003

Title
A single sentence description.
Phonon dispersion relations for fcc Ni
Description Given a value of the zero-temperature, zero-pressure lattice constant for fcc Ni as input, the corresponding phonon dispersion curves are calculated and plotted.
Species
The supported atomic species.
Ni
Disclaimer
A statement of applicability provided by the contributor, informing users of the intended use of this KIM Item.
Computer generated
Contributor Matt Bierbaum
Maintainer Matt Bierbaum
Published on KIM 2018
How to Cite Click here to download this citation in BibTeX format.
Funding Not available
Short KIM ID
The unique KIM identifier code.
TE_948896757313_003
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.
PhononDispersionCurve_fcc_Ni__TE_948896757313_003
Citable Link https://openkim.org/cite/TE_948896757313_003
KIM Item TypeTest
DriverPhononDispersionCurve__TD_530195868545_003
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.
ase
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 PhononDispersionCurve_fcc_Ni__TE_948896757313_002


EAM_CubicNaturalSpline__MD_853402641673_002
Model Test Results Link to Test Results page Benchmark time
Usertime multiplied 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_CubicNaturalSpline_AngeloMoody_1995_Ni__MO_800536961967_002 view 89357
EAM_Dynamo__MD_120291908751_005
Model Test Results Link to Test Results page Benchmark time
Usertime multiplied 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_Ni__MO_977363131043_005 view 91571
EAM_Dynamo_AcklandTichyVitek_1987v2_Ni__MO_769632475533_000 view 90608
EAM_Dynamo_AdamsFoilesWolfer_1989Universal6_Ni__MO_258836200237_000 view 91988
EAM_Dynamo_AngeloMoodyBaskes_1995_NiAlH__MO_418978237058_005 view 90255
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EAM_Dynamo_BonnyPasianotCastin_2009_FeCuNi__MO_469343973171_005 view 90801
EAM_Dynamo_BonnyPasianotMalerba_2009_FeNi__MO_267721408934_005 view 91121
EAM_Dynamo_Foiles_1985_Ni__MO_010059867259_000 view 92790
EAM_Dynamo_FoilesBaskesDaw_1986Universal3_Ni__MO_580571659842_000 view 92437
EAM_Dynamo_MendelevKramerHao_2012_Ni__MO_832600236922_005 view 96319
EAM_Dynamo_MendelevKramerHao_2012_NiZr__MO_149104665840_005 view 95228
EAM_Dynamo_Mishin_2004_NiAl__MO_101214310689_005 view 91731
EAM_Dynamo_MishinFarkasMehl_1999_Ni__MO_400591584784_005 view 93014
EAM_Dynamo_MishinMehlPapaconstantopoulos_2002_NiAl__MO_109933561507_005 view 94490
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EAM_Dynamo_PunYamakovMishin_2015_NiCo__MO_010613863288_000 view 92309
EAM_Dynamo_TehranchiCurtin_2010_NiH__MO_535504325462_003 view 92501
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EAM_Dynamo_ZhangAshcraftMendelev_2016_NiNb__MO_047308317761_000 view 93271
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EAM_Dynamo_ZhouWadleyJohnson_2001NISTretabulation_Ni__MO_593762436933_000 view 92212
EAM_IMD__MD_113599595631_003
Model Test Results Link to Test Results page Benchmark time
Usertime multiplied 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)
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Model Test Results Link to Test Results page Benchmark time
Usertime multiplied 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_Standard_JacobsenStoltzeNorskov_1996_AlAgAuCuNiPdPt__MO_115316750986_001 view 92084
EMT_Asap_Standard_JacobsenStoltzeNorskov_1996_Ni__MO_108408461881_001 view 91314
LJ__MD_414112407348_003
Model Test Results Link to Test Results page Benchmark time
Usertime multiplied 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)
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003 view 93432
Morse_Shifted__MD_552566534109_003
Model Test Results Link to Test Results page Benchmark time
Usertime multiplied 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_Ni__MO_381861218831_003 view 88683
Morse_Shifted_GirifalcoWeizer_1959LowCutoff_Ni__MO_322509103239_003 view 86052
Morse_Shifted_GirifalcoWeizer_1959MedCutoff_Ni__MO_758825945924_003 view 91924
No Driver
Model Test Results Link to Test Results page Benchmark time
Usertime multiplied 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)
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Sim_LAMMPS_MEAM_Wagner_2007_Ni__SM_168413969663_000 view 76651


No Driver
Model Error Categories Link to Error page
Sim_LAMMPS_MEAM_Wagner_2007_Ni__SM_168413969663_000 other view




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