[ { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/binding-energy-crystal" "instance-id" 1 "prototype-label" { "source-value" "A2B_mP12_11_4e_2e" } "stoichiometric-species" { "source-value" [ "O" "Ti" ] } "a" { "source-value" 11.508 "source-unit" "angstrom" } "binding-potential-energy-per-atom" { "source-value" -7.42564 "source-unit" "eV" } "binding-potential-energy-per-formula" { "source-value" -22.276919999999997 "source-unit" "eV" } "parameter-names" { "source-value" [ "b/a" "c/a" "beta" "x1" "z1" "x2" "z2" "x3" "z3" "x4" "z4" "x5" "z5" "x6" "z6" ] } "parameter-values" { "source-value" [ 0.34392596 0.53848627 92.1894 0.85707112 0.83755525 0.78207661 0.34399313 0.064152503 0.46367014 0.60563977 0.95200051 0.74243766 0.044480606 0.90065783 0.55167874 ] } } { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/crystal-structure-npt" "instance-id" 2 "prototype-label" { "source-value" "A2B_mP12_11_4e_2e" } "stoichiometric-species" { "source-value" [ "O" "Ti" ] } "a" { "source-value" 11.508 "source-unit" "angstrom" } "cell-cauchy-stress" { "source-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 ] "source-unit" "eV/angstrom^3" } "temperature" { "source-value" 0.0 "source-unit" "K" } "parameter-names" { "source-value" [ "b/a" "c/a" "beta" "x1" "z1" "x2" "z2" "x3" "z3" "x4" "z4" "x5" "z5" "x6" "z6" ] } "parameter-values" { "source-value" [ 0.34392596 0.53848627 92.1894 0.85707112 0.83755525 0.78207661 0.34399313 0.064152503 0.46367014 0.60563977 0.95200051 0.74243766 0.044480606 0.90065783 0.55167874 ] } } ]