[ { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/binding-energy-crystal" "instance-id" 1 "prototype-label" { "source-value" "A2B3_oF40_43_b_ab" } "stoichiometric-species" { "source-value" [ "Ag" "O" ] } "a" { "source-value" 13.0502 "source-unit" "angstrom" } "binding-potential-energy-per-atom" { "source-value" -2.97191 "source-unit" "eV" } "binding-potential-energy-per-formula" { "source-value" -14.859549999999999 "source-unit" "eV" } "parameter-names" { "source-value" [ "b/a" "c/a" "z1" "x2" "y2" "z2" "x3" "y3" "z3" ] } "parameter-values" { "source-value" [ 0.81831696 0.28929825 0.16699182 0.54684454 0.13337985 0.99871122 0.91732275 0.23370296 0.38239287 ] } "library-prototype-label" { "source-value" "A2B3_oF40_43_b_ab-001" } "short-name" { "source-value" "metal-oxide; Au2O3, ICSD #8014" } } { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/crystal-structure-npt" "instance-id" 2 "prototype-label" { "source-value" "A2B3_oF40_43_b_ab" } "stoichiometric-species" { "source-value" [ "Ag" "O" ] } "a" { "source-value" 13.0502 "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" "z1" "x2" "y2" "z2" "x3" "y3" "z3" ] } "parameter-values" { "source-value" [ 0.81831696 0.28929825 0.16699182 0.54684454 0.13337985 0.99871122 0.91732275 0.23370296 0.38239287 ] } "library-prototype-label" { "source-value" "A2B3_oF40_43_b_ab-001" } "short-name" { "source-value" "metal-oxide; Au2O3, ICSD #8014" } } ]