[ { "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" 2.4382 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.4382e-10 } "binding-potential-energy-per-atom" { "source-value" -43.97294479920395 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.045242468545638e-18 } "binding-potential-energy-per-formula" { "source-value" -131.91883439761185 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.113572740563692e-17 } "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" [ 1.6107784 1.8643672 0.21369527 0.045322889 0.27940061 0.49981112 0.66282288 0.96715474 0.4723826 0.50616824 0.46038364 0.72140827 0.88465616 0.29281218 0.93632036 0.68118895 0.48379505 0.78327229 0.79689331 0.7381914 ] } } { "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" 2.4382 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.4382e-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" [ 1.6107784 1.8643672 0.21369527 0.045322889 0.27940061 0.49981112 0.66282288 0.96715474 0.4723826 0.50616824 0.46038364 0.72140827 0.88465616 0.29281218 0.93632036 0.68118895 0.48379505 0.78327229 0.79689331 0.7381914 ] } } ]