[ { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/binding-energy-crystal" "instance-id" 1 "prototype-label" { "source-value" "A3B_cP4_221_c_a" } "stoichiometric-species" { "source-value" [ "Pt" "Ti" ] } "a" { "source-value" 3.9438 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.9438e-10 } "binding-potential-energy-per-atom" { "source-value" -6.257619054880641 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.002581103420293e-18 } "binding-potential-energy-per-formula" { "source-value" -25.030476219522566 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.010324413681171e-18 } "library-prototype-label" { "source-value" "AB3_cP4_221_a_c" } "short-name" { "source-value" "Cu3Au" } } { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/crystal-structure-npt" "instance-id" 2 "prototype-label" { "source-value" "A3B_cP4_221_c_a" } "stoichiometric-species" { "source-value" [ "Pt" "Ti" ] } "a" { "source-value" 3.9438 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.9438e-10 } "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 } "library-prototype-label" { "source-value" "AB3_cP4_221_a_c" } "short-name" { "source-value" "Cu3Au" } } ]