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VacancyFormationMigration_fcc_Cu__TE_038488899376_000

Title
A single sentence description.
Vacancy formation and migration energy for fcc Cu
Description
Species
The supported atomic species.
Cu
Contributor jl2922
Maintainer karls
Author Junhao Li
Publication Year 2018
Source Citations
A citation to primary published work(s) that describe this KIM Item.

Jónsson H, Mills G, Jacobsen KW (1998) Nudged elastic band method for finding minimum energy paths of transitions. Classical and Quantum Dynamics in Condensed Phase Simulations, pp 385–404. doi:10.1142/9789812839664_0016

Item Citation Click here to download a citation in BibTeX format.
Short KIM ID
The unique KIM identifier code.
TE_038488899376_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.
VacancyFormationMigration_fcc_Cu__TE_038488899376_000
Citable Link https://openkim.org/cite/TE_038488899376_000
KIM Item TypeTest
DriverVacancyFormationMigration__TD_554849987965_000
Properties
Properties as defined in kimspec.edn. These properties are inhereted from the Test Driver.
KIM API Version1.9.0
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
VacancyFormationMigration fcc Cu TE_038488899376_000


Models

EAM_Dynamo__MD_120291908751_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)
EAM_Dynamo_Ackland_Tichy_Cu__MO_179025990738_004 view 350205
EAM_Dynamo_Bonny_Pasianot_FeCuNi__MO_469343973171_004 view 220789
EAM_Dynamo_Cai_Ye_AlCu__MO_942551040047_004 view 274264
EAM_Dynamo_Foiles_Baskes_Universal3_Cu__MO_666348409573_003 view 222942
EAM_Dynamo_Hoyt_Garvin_PbCu__MO_119135752160_004 view 228146
EAM_Dynamo_Mendelev_King_Cu__MO_748636486270_004 view 241282
EAM_Dynamo_Mendelev_Kramer_Cu__MO_945691923444_004 view 246342
EAM_Dynamo_Mendelev_Kramer_CuZr__MO_600021860456_004 view 350348
EAM_Dynamo_Mendelev_Sordelet_CuZr__MO_120596890176_004 view 335131
EAM_Dynamo_Mishin_Mehl_Cu__MO_346334655118_004 view 227752
EAM_Dynamo_Onat_Durukanoglu_CuNi__MO_592013496703_004 view 250146
EAM_Dynamo_Williams_Mishin_CuAg__MO_128703483589_004 view 241354
EAM_Dynamo_Wu_Trinkle_CuAg__MO_270337113239_004 view 213647
EAM_Dynamo_Zhou_Johnson_Cu__MO_127245782811_004 view 248567
EMT_Asap__MD_128315414717_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)
EMT_Asap_MetalGlass_CuMgZr__MO_655725647552_002 view 204424
EMT_Asap_Standard_Jacobsen_Stoltze_Norskov_AlAgAuCuNiPdPt__MO_118428466217_002 view 198861
Pair_Morse_Shifted__MD_552566534109_001
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)
Pair_Morse_Shifted_GirifalcoWeizer_HighCutoff_Cu__MO_151002396060_001 view 878150
Pair_Morse_Shifted_GirifalcoWeizer_LowCutoff_Cu__MO_673777079812_001 view 320166
Pair_Morse_Shifted_GirifalcoWeizer_MedCutoff_Cu__MO_173787283511_001 view 743008
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_Johnson_NearestNeighbor_Cu__MO_887933271505_001 view 215778



Download Dependency

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VacancyFormationMigration__TD_554849987965_000.txz Tar+XZ Linux and OS X archive
VacancyFormationMigration__TD_554849987965_000.zip Zip Windows archive

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