{ "title" "Elastic constants for AlO in AFLOW crystal prototype A2B_cF12_225_c_a at zero temperature and pressure v000" "description" "Given the zero-pressure, zero-temperature structure of AlO in AFLOW crystal prototype A2B_cF12_225_c_a, this Test computes the corresponding elastic constants using numerical differentiation. By default, the Hessian of the energy w.r.t. strain is used, but depending on the computed uncertainty and material symmetry violation, the Jacobian of the stress w.r.t. strain may be used instead." "extended-id" "ElasticConstantsCrystal_A2B_cF12_225_c_a_AlO__TE_056856833524_000" "test-driver" "ElasticConstantsCrystal__TD_034002468289_000" "species" ["Al" "O"] "contributor-id" "4ad03136-ed7f-4316-b586-1e94ccceb311" "maintainer-id" "4ad03136-ed7f-4316-b586-1e94ccceb311" "executables" ["runner"] "domain" "openkim.org" "matching-models" ["standard-models"] "disclaimer" "Computer generated" "kim-api-version" "2.3" "publication-year" "2024" }