[ { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/binding-energy-crystal" "instance-id" 1 "prototype-label" { "source-value" "A2B3C12D3_cI160_230_a_c_h_d" } "stoichiometric-species" { "source-value" [ "Al" "Ca" "O" "Si" ] } "a" { "source-value" 11.9673 "source-unit" "angstrom" "si-unit" "m" "si-value" 1.19673e-09 } "binding-potential-energy-per-atom" { "source-value" -14.280879850183453 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.288049200892535e-18 } "binding-potential-energy-per-formula" { "source-value" -285.61759700366906 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.576098401785069e-17 } "parameter-names" { "source-value" [ "x4" "y4" "z4" ] } "parameter-values" { "source-value" [ 0.45801338 0.95701113 0.15277048 ] } "library-prototype-label" { "source-value" "A2B3C12D3_cI160_230_a_c_h_d-001" } "short-name" { "source-value" "Garnet" } } { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/crystal-structure-npt" "instance-id" 2 "prototype-label" { "source-value" "A2B3C12D3_cI160_230_a_c_h_d" } "stoichiometric-species" { "source-value" [ "Al" "Ca" "O" "Si" ] } "a" { "source-value" 11.9673 "source-unit" "angstrom" "si-unit" "m" "si-value" 1.19673e-09 } "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 } "parameter-names" { "source-value" [ "x4" "y4" "z4" ] } "parameter-values" { "source-value" [ 0.45801338 0.95701113 0.15277048 ] } "library-prototype-label" { "source-value" "A2B3C12D3_cI160_230_a_c_h_d-001" } "short-name" { "source-value" "Garnet" } } ]