Test Drivers - Alphabetical


Extended KIM ID Title
binary_alloy_elastic_constant__TD_601231739727_000 Elastic constant of binary alloy
ClusterEnergyAndForces__TD_000043093022_001 Conjugate gradient relaxation of atomic cluster
CohesiveEnergyVsLatticeConstant__TD_554653289799_001 Cohesive energy versus lattice constant curve for monoatomic cubic lattice
ElasticConstantsCubic__TD_011862047401_003 Elastic constants for cubic crystals at zero temperature
ElasticConstantsFirstStrainGradient__TD_361847723785_000 Classical and first strain gradient elastic constants for simple lattices
ElasticConstantsHexagonal__TD_612503193866_002 Elastic constants for hexagonal crystals at zero temperature
Grain_Boundary_Symmetric_Tilt_Relaxed_Energy_vs_Angle_Cubic_Crystal__TD_410381120771_000 The relaxed energy as a function of tilt angle for a symmetric tilt grain boundary within a cubic crystal
LammpsExample2__TD_887699523131_002 LammpsExample2: energy-volume curve for monoatomic cubic lattice
LammpsExample__TD_567444853524_003 LammpsExample: cohesive energy and equilibrium lattice constant of fcc Argon
LatticeConstant2DHexagonalEnergy__TD_034540307932_000 Cohesive energy and equilibrium lattice constant of hexagonal 2D crystalline layers
LatticeConstantCubicEnergy__TD_475411767977_003 Equilibrium lattice constants for bulk cubic structures
LatticeConstantHexagonalEnergy__TD_942334626465_003 Equilibrium lattice constants for hexagonal bulk structures
LatticeInvariantShearPathCubicCrystalCBKIM__TD_083627594945_001 Cohesive energy versus shear parameter relation for a cubic crystal
LinearThermalExpansionCoeffCubic__TD_522633393614_000 Linear thermal expansion coefficient of a cubic crystal structure
PhononDispersionCurve__TD_530195868545_002 Phonon dispersion relations for fcc lattices
SurfaceTest__TD_955413365818_002 Broken-bond fit of high-symmetry surface energies in cubic crystal lattices
TriclinicPBCEnergyAndForces__TD_892847239811_001 Potential energy and atomic forces of periodic, non-orthogonal cell of atoms
VacancyFormationEnergyRelaxationVolume__TD_647413317626_000 vacancy formation energy and relaxation volume for cubic and hcp crystals
VacancyFormationMigration__TD_554849987965_000 vacancy migration and formation energy for cubic and hcp crystals