{ "title" "Elastic constants for CsILi in AFLOW crystal prototype AB4C3_mP16_6_2a_3a5b_3a3b at zero temperature and pressure v000" "description" "Given the zero-pressure, zero-temperature structure of CsILi in AFLOW crystal prototype AB4C3_mP16_6_2a_3a5b_3a3b, 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_AB4C3_mP16_6_2a_3a5b_3a3b_CsILi__TE_504077861689_000" "test-driver" "ElasticConstantsCrystal__TD_034002468289_000" "species" ["Cs" "I" "Li"] "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" }