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VacancyFormationMigration_fcc_Ni__TE_762881942024_000

Title
A single sentence description.
Vacancy formation and migration energy for fcc Ni
Description
Species
The supported atomic species.
Ni
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_762881942024_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_Ni__TE_762881942024_000
Citable Link https://openkim.org/cite/TE_762881942024_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 Ni TE_762881942024_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_Angelo_Moody_Baskes_modified_by_Tehranchi_Curtin_Song_Ni_H__MO_535504325462_002 view 189350
EAM_Dynamo_Ackland_Tichy_Ni__MO_977363131043_004 view 118900
EAM_Dynamo_Angelo_Moody_NiAlH__MO_418978237058_004 view 187556
EAM_Dynamo_Bonny_Pasianot_FeCuNi__MO_469343973171_004 view 223230
EAM_Dynamo_Bonny_Pasianot_FeNi__MO_267721408934_004 view 212606
EAM_Dynamo_Mendelev_Ni__MO_832600236922_004 view 455037
EAM_Dynamo_Mendelev_NiZr__MO_149104665840_004 view 656553
EAM_Dynamo_Mishin_Farkas_Ni__MO_400591584784_004 view 245696
EAM_Dynamo_Mishin_Mehl_NiAl__MO_109933561507_004 view 101566
EAM_Dynamo_Mishin_NiAl__MO_101214310689_004 view 237944
EAM_Dynamo_Onat_Durukanoglu_CuNi__MO_592013496703_004 view 169899
EAM_Dynamo_PurjaPun_Mishin_NiAl__MO_751354403791_004 view 229223
EAM_Dynamo_Zhou_Johnson_Ni__MO_110256178378_004 view 177579
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_Standard_Jacobsen_Stoltze_Norskov_AlAgAuCuNiPdPt__MO_118428466217_002 view 278330
IMD_EAM__MD_113599595631_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)
IMD_EAM_Schopf_AlNiCo_A__MO_122703700223_002 view 1875313
IMD_EAM_Schopf_AlNiCo_B__MO_128037485276_002 view 681801
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_Ni__MO_381861218831_001 view 1020349
Pair_Morse_Shifted_GirifalcoWeizer_LowCutoff_Ni__MO_322509103239_001 view 333329
Pair_Morse_Shifted_GirifalcoWeizer_MedCutoff_Ni__MO_758825945924_001 view 527991



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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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