Tests for monovacancy-neutral-relaxed-formation-potential-energy-crystal-npt

By Species By Test Driver Alphabetical
The list below only includes Tests that have at least one result. To see all KIM Tests, see the Tests in the KIM Repository.

Link to Property Definition: monovacancy-neutral-relaxed-formation-potential-energy-crystal-npt

Ag
Test ID Test Title
VacancyFormationEnergyRelaxationVolume_fcc_Ag__TE_637108138696_000 Monovacancy formation energy and relaxation volume for fcc Ag
VacancyFormationMigration_fcc_Ag__TE_930419041081_000 Vacancy formation and migration energy for fcc Ag
Al
Test ID Test Title
VacancyFormationEnergyRelaxationVolume_fcc_Al__TE_472472909360_000 Monovacancy formation energy and relaxation volume for fcc Al
VacancyFormationMigration_fcc_Al__TE_209799619356_000 Vacancy formation and migration energy for fcc Al
Au
Test ID Test Title
VacancyFormationEnergyRelaxationVolume_fcc_Au__TE_498189415365_000 Monovacancy formation energy and relaxation volume for fcc Au
VacancyFormationMigration_fcc_Au__TE_591056455495_000 Vacancy formation and migration energy for fcc Au
Cu
Test ID Test Title
VacancyFormationEnergyRelaxationVolume_fcc_Cu__TE_864259611541_000 Monovacancy formation energy and relaxation volume for fcc Cu
VacancyFormationMigration_fcc_Cu__TE_038488899376_000 Vacancy formation and migration energy for fcc Cu
Fe
Test ID Test Title
VacancyFormationEnergyRelaxationVolume_bcc_Fe__TE_453995604594_000 Monovacancy formation energy and relaxation volume for bcc Fe
VacancyFormationMigration_bcc_Fe__TE_424131500075_000 Vacancy formation and migration energy for bcc Fe
Ge
Test ID Test Title
VacancyFormationEnergyRelaxationVolume_diamond_Ge__TE_644361879215_000 Monovacancy formation energy and relaxation volume for diamond Ge
VacancyFormationMigration_diamond_Ge__TE_771748688857_000 Vacancy formation and migration energy for diamond Ge
Mg
Test ID Test Title
VacancyFormationEnergyRelaxationVolume_hcp_Mg__TE_169055830505_000 Monovacancy formation energy and relaxation volume for hcp Mg
VacancyFormationMigration_hcp_Mg__TE_510743441348_000 Vacancy formation and migration energy for hcp Mg
Ni
Test ID Test Title
VacancyFormationEnergyRelaxationVolume_fcc_Ni__TE_904565390529_000 Monovacancy formation energy and relaxation volume for fcc Ni
VacancyFormationMigration_fcc_Ni__TE_762881942024_000 Vacancy formation and migration energy for fcc Ni
O
Test ID Test Title
VacancyFormationEnergyRelaxationVolume_sc_O__TE_032363109044_000 Monovacancy formation energy and relaxation volume for sc O
VacancyFormationMigration_sc_O__TE_006415178296_000 Vacancy formation and migration energy for sc O
Pt
Test ID Test Title
VacancyFormationEnergyRelaxationVolume_fcc_Pt__TE_437812956174_000 Monovacancy formation energy and relaxation volume for fcc Pt
VacancyFormationMigration_fcc_Pt__TE_143190656999_000 Vacancy formation and migration energy for fcc Pt
Si
Test ID Test Title
VacancyFormationEnergyRelaxationVolume_diamond_Si__TE_257097293769_000 Monovacancy formation energy and relaxation volume for diamond Si
VacancyFormationMigration_diamond_Si__TE_662280895854_000 Vacancy formation and migration energy for diamond Si
Ti
Test ID Test Title
VacancyFormationMigration_hcp_Ti__TE_626277981382_000 Vacancy formation and migration energy for hcp Ti
Zn
Test ID Test Title
VacancyFormationEnergyRelaxationVolume_hcp_Zn__TE_135749693728_000 Monovacancy formation energy and relaxation volume for hcp Zn
VacancyFormationMigration_hcp_Zn__TE_345855404704_000 Vacancy formation and migration energy for hcp Zn
Zr
Test ID Test Title
VacancyFormationEnergyRelaxationVolume_hcp_Zr__TE_109617109098_000 Monovacancy formation energy and relaxation volume for hcp Zr
VacancyFormationMigration_hcp_Zr__TE_178839066650_000 Vacancy formation and migration energy for hcp Zr