{ "title" "Elastic constants for CHO in AFLOW crystal prototype AB2C_oP80_60_c2d_5d_c2d at zero temperature and pressure v000" "description" "Given the zero-pressure, zero-temperature structure of CHO in AFLOW crystal prototype AB2C_oP80_60_c2d_5d_c2d, 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_AB2C_oP80_60_c2d_5d_c2d_CHO__TE_145399127796_000" "test-driver" "ElasticConstantsCrystal__TD_034002468289_000" "species" ["C" "H" "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" }