{ "title" "Elastic constants for CFe in AFLOW crystal prototype A6B23_cF116_225_e_acfh at zero temperature and pressure v000" "description" "Given the zero-pressure, zero-temperature structure of CFe in AFLOW crystal prototype A6B23_cF116_225_e_acfh, 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_A6B23_cF116_225_e_acfh_CFe__TE_533636279256_000" "test-driver" "ElasticConstantsCrystal__TD_034002468289_000" "species" ["C" "Fe"] "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" }