{ "title" "Elastic constants for BHN in AFLOW crystal prototype A2B8C_oP88_19_4a_16a_2a at zero temperature and pressure v000" "description" "Given the zero-pressure, zero-temperature structure of BHN in AFLOW crystal prototype A2B8C_oP88_19_4a_16a_2a, 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_A2B8C_oP88_19_4a_16a_2a_BHN__TE_677280993961_000" "test-driver" "ElasticConstantsCrystal__TD_034002468289_000" "species" ["B" "H" "N"] "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" }