{ "title" "Elastic constants for BH in AFLOW crystal prototype A3B5_oC64_36_2a2b_2a4b at zero temperature and pressure v000" "description" "Given the zero-pressure, zero-temperature structure of BH in AFLOW crystal prototype A3B5_oC64_36_2a2b_2a4b, 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_A3B5_oC64_36_2a2b_2a4b_BH__TE_889003175598_000" "test-driver" "ElasticConstantsCrystal__TD_034002468289_000" "species" ["B" "H"] "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" }