Reference elemental energy for Co v000

Jump to: Models | Files | Wiki

GroundStateCrystalStructure_Co__TE_888459213797_000

Title A single sentence description.	Reference elemental energy for Co v000
Description	Returns the reference elemental energy for Co.
Species The supported atomic species.	Co
Disclaimer A statement of applicability provided by the contributor, informing users of the intended use of this KIM Item.	Computer generated

Contributor	Eric Fuemmeler
Maintainer	Eric Fuemmeler
Published on KIM	2025
How to Cite	This Test is archived in OpenKIM [1-4]. [1] Reference elemental energy for Co v000 [Internet]. OpenKIM; 2025. Available from: https://openkim.org/cite/TE_888459213797_000 [2] Fuemmeler E. Test driver for computing reference ground state structures and energies for each element at zero temperature and applied stress v000. OpenKIM; 2025. doi:10.25950/fa5ed729 [3] Tadmor EB, Elliott RS, Sethna JP, Miller RE, Becker CA. The potential of atomistic simulations and the Knowledgebase of Interatomic Models. JOM. 2011;63(7):17. doi:10.1007/s11837-011-0102-6 [4] Elliott RS, Tadmor EB. Knowledgebase of Interatomic Models (KIM) Application Programming Interface (API). OpenKIM; 2011. doi:10.25950/ff8f563a
Funding	Not available

Short KIM ID The unique KIM identifier code.	TE_888459213797_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.	GroundStateCrystalStructure_Co__TE_888459213797_000
Citable Link	https://openkim.org/cite/TE_888459213797_000
KIM Item Type	Test
Driver	GroundStateCrystalStructure__TD_099540502402_000
Properties Properties as defined in kimspec.edn. These properties are inhereted from the Test Driver.	tag:staff@noreply.openkim.org,2025-09-10:property/elemental-crystal-ground-state
KIM API Version	2.3
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

Models

EAM_Dynamo__MD_120291908751_006

Model	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_BelandLuOsetskiy_2016_CoNi__MO_871937946490_001	view	28679
EAM_Dynamo_DeluigiPasianotValencia_2021_FeNiCrCoCu__MO_657255834688_001	view	28679
EAM_Dynamo_FarkasCaro_2018_FeNiCrCoCu__MO_803527979660_001	view	26640
EAM_Dynamo_FarkasCaro_2020_FeNiCrCoAl__MO_820335782779_001	view	27000
EAM_Dynamo_PunMishin_2012_Co__MO_885079680379_006	view	26820
EAM_Dynamo_PunYamakovMishin_2013_AlCo__MO_678952612413_001	view	27480
EAM_Dynamo_PunYamakovMishin_2013_NiAlCo__MO_826591359508_001	view	26127
EAM_Dynamo_VailheFarkas_1997_CoAl__MO_284963179498_006	view	26640
EAM_Dynamo_ZhouJohnsonWadley_2004_Co__MO_924630542818_006	view	26066
EAM_Dynamo_ZhouJohnsonWadley_2004_CuAgAuNiPdPtAlPbFeMoTaWMgCoTiZr__MO_870117231765_001	view	27707
EAM_Dynamo_ZhouJohnsonWadley_2004NISTretabulation_Co__MO_247800397145_001	view	26880

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)
EAM_IMD_BrommerGaehler_2006A_AlNiCo__MO_122703700223_003		view	27240
EAM_IMD_BrommerGaehler_2006B_AlNiCo__MO_128037485276_003		view	27600

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 This Model has a disclaimer This model was automatically fit using Lorentz-Berthelot mixing rules. It reproduces the dimer equilibrium separation (covalent radii) and the bond dissociation energies. It has not been fitted to other physical properties and its ability to model structures other than dimers is unknown.		view	27524

MEAM_LAMMPS__MD_249792265679_002

Model	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)
MEAM_LAMMPS_ChoiJoSohn_2018_CoNiCrFeMn__MO_115454747503_002	view	31320
MEAM_LAMMPS_ChoiKimSeol_2017_CoCr__MO_410167849923_002	view	31200
MEAM_LAMMPS_ChoiKimSeol_2017_CoFe__MO_179158257180_002	view	32689
MEAM_LAMMPS_ChoiKimSeol_2017_CoMn__MO_808662295149_002	view	33000
MEAM_LAMMPS_DongKimKo_2012_CoAl__MO_099716416216_002	view	31352
MEAM_LAMMPS_JeongParkDo_2018_PdCo__MO_101997554790_002	view	31656
MEAM_LAMMPS_KimJungLee_2015_NiAlCo__MO_876687166519_002	view	32460
MEAM_LAMMPS_KimSeolJi_2017_PtCo__MO_545073984441_002	view	34080
MEAM_LAMMPS_OhSeolLee_2020_CoTi__MO_862371677648_002	view	29529
MEAM_LAMMPS_OhSeolLee_2020_CoV__MO_771146361182_002	view	37980
MEAM_LAMMPS_SharifiWick_2025_FeMnNiTiCuCrCoAl__MO_675947402254_000 This Model has a disclaimer This potential is designed for the structural properties of High Entropy Alloys (HEA)s and Complex Concentrated Alloys (CCAs). The fitting procedure involved developing all included unary, binary and ternary systems so it can be used for any alloy subset. This potential focuses on the structural analysis of alloys including shear strength and elastic constants, dislocation dynamics and their impact on alloy strength, and the analysis of defect effects, such as voids, on material properties. However, the potential was not optimized for temperature-dependent properties and was not fit to density, thermal expansion coefficients, or thermal conductivity data.	view	30684
MEAM_LAMMPS_WangOhLee_2020_CuCo__MO_694335101831_002	view	30840
MEAM_LAMMPS_WangOhLee_2020_CuCo__MO_849011491644_002	view	29833

Tersoff_LAMMPS__MD_077075034781_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)
Tersoff_LAMMPS_PetismeGrenWahnstrom_2015_WCCo__MO_454528624659_000		view	27360

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)
Sim_LAMMPS_HybridOverlay_BelandLuOsetskiy_2016_CoNi__SM_445377835613_001		view	24851
Sim_LAMMPS_Table_GrogerVitekDlouhy_2020_CoCrFeMnNi__SM_786004631953_001		view	27420

Errors

No Errors associated with this Test

Files

Download

Download Dependency

This Test requires a Test Driver. Click below for the Test Driver GroundStateCrystalStructure__TD_099540502402_000 archive.

Wiki

Wiki is ready to accept new content.