[ { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/binding-energy-crystal" "instance-id" 1 "prototype-label" { "source-value" "A2B_oP24_54_acde_f" } "stoichiometric-species" { "source-value" [ "O" "Si" ] } "a" { "source-value" 7.641 "source-unit" "angstrom" "si-unit" "m" "si-value" 7.641000000000001e-10 } "parameter-names" { "source-value" [ "b/a" "c/a" "y2" "z3" "z4" "x5" "y5" "z5" ] } "parameter-values" { "source-value" [ 0.5527287 1.0871745 0.60582984 0.79748063 0.96573168 0.88113009 0.7630383 0.11301689 ] } "binding-potential-energy-per-atom" { "source-value" -8.990661448405767 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.440462769684032e-18 } "binding-potential-energy-per-formula" { "source-value" -26.9719843452173 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.321388309052094e-18 } "coordinates-file" { "source-value" "instance-1.poscar" } } { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/crystal-structure-npt" "instance-id" 2 "prototype-label" { "source-value" "A2B_oP24_54_acde_f" } "stoichiometric-species" { "source-value" [ "O" "Si" ] } "a" { "source-value" 7.641 "source-unit" "angstrom" "si-unit" "m" "si-value" 7.641000000000001e-10 } "parameter-names" { "source-value" [ "b/a" "c/a" "y2" "z3" "z4" "x5" "y5" "z5" ] } "parameter-values" { "source-value" [ 0.5527287 1.0871745 0.60582984 0.79748063 0.96573168 0.88113009 0.7630383 0.11301689 ] } "cell-cauchy-stress" { "source-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 ] "source-unit" "eV/angstrom^3" "si-unit" "kg / m s^2" "si-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 ] } "temperature" { "source-value" 0.0 "source-unit" "K" "si-unit" "K" "si-value" 0.0 } "coordinates-file" { "source-value" "instance-2.poscar" } } ]