{ "title" "Elastic constants for AlFeMgSi in AFLOW crystal prototype A9BC3D5_hP18_189_fi_a_g_bh at zero temperature and pressure v000" "description" "Given the zero-pressure, zero-temperature structure of AlFeMgSi in AFLOW crystal prototype A9BC3D5_hP18_189_fi_a_g_bh, 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_A9BC3D5_hP18_189_fi_a_g_bh_AlFeMgSi__TE_083198099740_000" "test-driver" "ElasticConstantsCrystal__TD_034002468289_000" "species" ["Al" "Fe" "Mg" "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" }