Jump to: Models | Files | Wiki

LatticeConstantCubicEnergy_diamond_V__TE_484165392257_007

Title
A single sentence description.
Equilibrium zero-temperature lattice constant for diamond V v007
Description Equilibrium lattice constant and cohesive energy of diamond V at zero temperature and pressure.
Species
The supported atomic species.
V
Disclaimer
A statement of applicability provided by the contributor, informing users of the intended use of this KIM Item.
This Test was computer-generated
Contributor Daniel S. Karls
Maintainer Daniel S. Karls
Published on KIM 2019
How to Cite

This Test is archived in OpenKIM [1-4].

[1] Karls DS, Li J. Equilibrium zero-temperature lattice constant for diamond V v007 [Internet]. OpenKIM; 2019. Available from: https://openkim.org/cite/TE_484165392257_007

[2] Karls DS, Li J. Equilibrium lattice constant and cohesive energy of a cubic lattice at zero temperature and pressure v007. OpenKIM; 2019. doi:10.25950/2765e3bf

[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

Click here to download the above citation in BibTeX format.
Funding Not available
Short KIM ID
The unique KIM identifier code.
TE_484165392257_007
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.
LatticeConstantCubicEnergy_diamond_V__TE_484165392257_007
Citable Link https://openkim.org/cite/TE_484165392257_007
KIM Item TypeTest
DriverLatticeConstantCubicEnergy__TD_475411767977_007
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 LatticeConstantCubicEnergy_diamond_V__TE_484165392257_006


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_HanZepedaAckland_2003_V__MO_411020944797_000 view 3679
EAM_Dynamo_MendelevHanSon_2007_VFe__MO_249706810527_005 view 4031
EAM_Dynamo_Olsson_2009_V__MO_944449444863_000 view 11358
EAM_MagneticCubic__MD_620624592962_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_MagneticCubic_DerletNguyenDudarev_2007_V__MO_683890323730_002 view 3007
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 6782
MEAM_LAMMPS__MD_249792265679_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)
MEAM_LAMMPS_KimSeolJi_2017_PtV__MO_912978207512_002 view 18102
MEAM_LAMMPS_KoLee_2013_VPdY__MO_046547823135_002 view 16461
MEAM_LAMMPS_LeeBaskesKim_2001_V__MO_868364924829_001 view 12602
MEAM_LAMMPS_MaiselKoZhang_2017_VNiTi__MO_744610363128_002 view 35597
MEAM_LAMMPS_OhSeolLee_2020_CoV__MO_771146361182_002 view 23920
MEAM_LAMMPS_ShimKoKim_2013_AlVH__MO_344724145339_002 view 26586
MEAM_LAMMPS_ShimKoKim_2013_NiVH__MO_612225165948_002 view 24766
MEAM_LAMMPS_ShimLeeFleury_2011_VH__MO_072444764353_002 view 13696
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_MEAM_MaiselKoZhang_2017_VNiTi__SM_971529344487_000 view 9949
Sim_LAMMPS_ReaxFF_ChenowethVanDuinPersson_2008_CHOV__SM_429148913211_001 view 43283


MEAM_2NN__MD_111291751625_001
Model Error Categories Link to Error page
MEAM_2NN_Fe_to_Ga__MO_145522277939_001 mismatch view




This Test requires a Test Driver. Archives for the Test Driver LatticeConstantCubicEnergy__TD_475411767977_007 appear below.


LatticeConstantCubicEnergy__TD_475411767977_007.txz Tar+XZ Linux and OS X archive
LatticeConstantCubicEnergy__TD_475411767977_007.zip Zip Windows archive
Wiki is ready to accept new content.

Login to edit Wiki content