[ { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/binding-energy-crystal" "instance-id" 1 "prototype-label" { "source-value" "AB2_oP24_19_2a_4a" } "stoichiometric-species" { "source-value" [ "C" "O" ] } "a" { "source-value" 3.9551 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.9551e-10 } "binding-potential-energy-per-atom" { "source-value" -5.7784728849376386 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.258134236449655e-19 } "binding-potential-energy-per-formula" { "source-value" -17.335418654812916 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.777440270934896e-18 } "parameter-names" { "source-value" [ "b/a" "c/a" "x1" "y1" "z1" "x2" "y2" "z2" "x3" "y3" "z3" "x4" "y4" "z4" "x5" "y5" "z5" "x6" "y6" "z6" ] } "parameter-values" { "source-value" [ 1.7168972 1.8236454 0.50280486 0.82415365 0.41665876 0.56037884 0.70076244 0.084419492 0.79720705 0.49836245 0.58943581 0.6938452 0.80769906 0.24507304 0.25984223 0.66256033 0.4367633 0.69372989 0.79910717 0.91834476 ] } } { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/crystal-structure-npt" "instance-id" 2 "prototype-label" { "source-value" "AB2_oP24_19_2a_4a" } "stoichiometric-species" { "source-value" [ "C" "O" ] } "a" { "source-value" 3.9551 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.9551e-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 } "parameter-names" { "source-value" [ "b/a" "c/a" "x1" "y1" "z1" "x2" "y2" "z2" "x3" "y3" "z3" "x4" "y4" "z4" "x5" "y5" "z5" "x6" "y6" "z6" ] } "parameter-values" { "source-value" [ 1.7168972 1.8236454 0.50280486 0.82415365 0.41665876 0.56037884 0.70076244 0.084419492 0.79720705 0.49836245 0.58943581 0.6938452 0.80769906 0.24507304 0.25984223 0.66256033 0.4367633 0.69372989 0.79910717 0.91834476 ] } } ]