Jump to: Models | Files | Wiki

LatticeConstantCubicEnergy_diamond_Ti__TE_302148205183_006

Title
A single sentence description.
Equilibrium zero-temperature lattice constant for diamond Ti
Description Equilibrium lattice constant and cohesive energy of diamond Ti at zero temperature and pressure.
Species
The supported atomic species.
Ti
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 karls
Maintainer karls
Author Junhao Li
Publication Year 2019
Item Citation Click here to download this citation in BibTeX format.
Funding Not available
Short KIM ID
The unique KIM identifier code.
TE_302148205183_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_Ti__TE_302148205183_006
Citable Link https://openkim.org/cite/TE_302148205183_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_Ti__TE_302148205183_005


Models

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_Ackland_1992_Ti__MO_748534961139_005 view 1444
EAM_Dynamo_FarkasJones_1996_NbTiAl__MO_042691367780_000 view 1508
EAM_Dynamo_ZhouJohnsonWadley_2004_Ti__MO_723456820410_005 view 1444
EAM_Dynamo_ZhouWadleyJohnson_2001NISTretabulation_Ti__MO_101966451181_000 view 1412
EAM_Dynamo_ZopeMishin_2003_TiAl__MO_117656786760_005 view 1412
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 5134
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_MEAM_AlmyrasSangiovanniSarakinos_2019_NAlTi__SM_871795249052_000 view 5198
Sim_LAMMPS_MEAM_HennigLenoskyTrinkle_2008_Ti__SM_318953488749_000 view 5134
Sim_LAMMPS_MEAM_KimJungLee_2009_FeTiC__SM_531038274471_000 view 4299
Sim_LAMMPS_MEAM_KoGrabowskiNeugebauer_2015_NiTi__SM_770142935022_000 view 4299
Sim_LAMMPS_MEAM_MaiselKoZhang_2017_VNiTi__SM_971529344487_000 view 4107





Download Dependency

This Test requires a Test Driver. Archives for the Test Driver LatticeConstantCubicEnergy__TD_475411767977_006 appear below.


LatticeConstantCubicEnergy__TD_475411767977_006.txz Tar+XZ Linux and OS X archive
LatticeConstantCubicEnergy__TD_475411767977_006.zip Zip Windows archive

Wiki

Wiki is ready to accept new content.

Login to edit Wiki content