{ "title" "Elastic constants for PdTi in AFLOW crystal prototype A5B3_tP8_123_agh_bh at zero temperature and pressure v000" "description" "Given the zero-pressure, zero-temperature structure of PdTi in AFLOW crystal prototype A5B3_tP8_123_agh_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_A5B3_tP8_123_agh_bh_PdTi__TE_772922077452_000" "test-driver" "ElasticConstantsCrystal__TD_034002468289_000" "species" ["Pd" "Ti"] "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" }