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LatticeConstantCubicEnergy_diamond_C__TE_072855742236_006

Title
A single sentence description.
Equilibrium zero-temperature lattice constant for diamond C
Description Equilibrium lattice constant and cohesive energy of diamond C at zero temperature and pressure.
Species
The supported atomic species.
C
Disclaimer
A short statement of applicability which will accompany any results computed using it. A developer can use the disclaimer to inform users of the intended use of this KIM Item.
This Test was computer-generated
Contributor karls
Maintainer karls
Author Junhao Li
Publication Year 2019
Item Citation Click here to download a citation in BibTeX format.
Short KIM ID
The unique KIM identifier code.
TE_072855742236_006
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_C__TE_072855742236_006
Citable Link https://openkim.org/cite/TE_072855742236_006
KIM Item TypeTest
DriverLatticeConstantCubicEnergy__TD_475411767977_006
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_C__TE_072855742236_005


Models

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)
Sim_LAMMPS_BOP_ZhouWardFoster_2015_CCu__SM_784926969362_000 view 15465
Sim_LAMMPS_EDIP_JiangMorganSzlufarska_2012_SiC__SM_435704953434_000 view 3914
Sim_LAMMPS_GW_GaoWeber_2002_SiC__SM_606253546840_000 view 3497
Sim_LAMMPS_GWZBL_Samolyuk_2016_SiC__SM_720598599889_000 view 3690
Sim_LAMMPS_LCBOP_LosFasolino_2003_C__SM_469631949122_000 view 7957
Sim_LAMMPS_MEAM_KimJungLee_2009_FeTiC__SM_531038274471_000 view 4652
Sim_LAMMPS_MEAM_LiyanageSeongGonHouze_2014_FeC__SM_652425777808_000 view 3818
Sim_LAMMPS_MEAM_Wagner_2007_SiC__SM_264944083668_000 view 4267
Sim_LAMMPS_TersoffZBL_DevanathanDiazdelaRubiaWeber_1998_SiC__SM_578912636995_000 view 4364
Sim_LAMMPS_TersoffZBL_HenrikssonBjorkasNordlund_2013_FeC__SM_473463498269_000 view 4460
EAM_Dynamo__MD_120291908751_005
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_HepburnAckland_2008_FeC__MO_143977152728_005 view 1508
LJ__MD_414112407348_003
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)
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003 view 18738





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LatticeConstantCubicEnergy__TD_475411767977_006.zip Zip Windows archive

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