{ "title" "Elastic constants for CHNO in AFLOW crystal prototype A3B6C4D3_mC128_15_3f_6f_4f_3f at zero temperature and pressure v000" "description" "Given the zero-pressure, zero-temperature structure of CHNO in AFLOW crystal prototype A3B6C4D3_mC128_15_3f_6f_4f_3f, 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_A3B6C4D3_mC128_15_3f_6f_4f_3f_CHNO__TE_546839608141_000" "test-driver" "ElasticConstantsCrystal__TD_034002468289_000" "species" ["C" "H" "N" "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" }