{ "title" "Elastic constants for HOSi in AFLOW crystal prototype A6BC2_oP36_19_6a_a_2a at zero temperature and pressure v000" "description" "Given the zero-pressure, zero-temperature structure of HOSi in AFLOW crystal prototype A6BC2_oP36_19_6a_a_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_A6BC2_oP36_19_6a_a_2a_HOSi__TE_795514092749_000" "test-driver" "ElasticConstantsCrystal__TD_034002468289_000" "species" ["H" "O" "Si"] "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" }