[ { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/binding-energy-crystal" "instance-id" 1 "prototype-label" { "source-value" "AB2_oP24_51_afj_cf2ij" } "stoichiometric-species" { "source-value" [ "Al" "Pt" ] } "a" { "source-value" 16.6508 "source-unit" "angstrom" "si-unit" "m" "si-value" 1.66508e-09 } "parameter-names" { "source-value" [ "b/a" "c/a" "z3" "z4" "x5" "z5" "x6" "z6" "x7" "z7" "x8" "z8" ] } "parameter-values" { "source-value" [ 0.23455329 0.33338939 0.25728535 0.75525535 0.83230786 0.99345942 0.83324027 0.49287629 0.91756881 0.24211591 0.91515839 0.74235923 ] } "binding-potential-energy-per-atom" { "source-value" -4.908966758253056 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.865031837155773e-19 } "binding-potential-energy-per-formula" { "source-value" -14.726900274759169 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.359509551146732e-18 } "coordinates-file" { "source-value" "instance-1.poscar" } } { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/crystal-structure-npt" "instance-id" 2 "prototype-label" { "source-value" "AB2_oP24_51_afj_cf2ij" } "stoichiometric-species" { "source-value" [ "Al" "Pt" ] } "a" { "source-value" 16.6508 "source-unit" "angstrom" "si-unit" "m" "si-value" 1.66508e-09 } "parameter-names" { "source-value" [ "b/a" "c/a" "z3" "z4" "x5" "z5" "x6" "z6" "x7" "z7" "x8" "z8" ] } "parameter-values" { "source-value" [ 0.23455329 0.33338939 0.25728535 0.75525535 0.83230786 0.99345942 0.83324027 0.49287629 0.91756881 0.24211591 0.91515839 0.74235923 ] } "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 } "coordinates-file" { "source-value" "instance-2.poscar" } } ]