[ { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/binding-energy-crystal" "instance-id" 1 "prototype-label" { "source-value" "A2B_mP12_14_2e_e" } "stoichiometric-species" { "source-value" [ "O" "V" ] } "a" { "source-value" 6.0654 "source-unit" "angstrom" } "binding-potential-energy-per-atom" { "source-value" -7.91759 "source-unit" "eV" } "binding-potential-energy-per-formula" { "source-value" -23.752769999999998 "source-unit" "eV" } "parameter-names" { "source-value" [ "b/a" "c/a" "beta" "x1" "y1" "z1" "x2" "y2" "z2" "x3" "y3" "z3" ] } "parameter-values" { "source-value" [ 0.74366076 0.89651136 123.9168 0.89973026 0.20174019 0.80061207 0.60008995 0.7006423 0.70133933 0.75025857 0.99842586 0.99817603 ] } "library-prototype-label" { "source-value" "A2B_mP12_14_2e_e-003" } "short-name" { "source-value" "O2V binary oxide (R. Friedrich), ICSD #647610" } } { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/crystal-structure-npt" "instance-id" 2 "prototype-label" { "source-value" "A2B_mP12_14_2e_e" } "stoichiometric-species" { "source-value" [ "O" "V" ] } "a" { "source-value" 6.0654 "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" "y1" "z1" "x2" "y2" "z2" "x3" "y3" "z3" ] } "parameter-values" { "source-value" [ 0.74366076 0.89651136 123.9168 0.89973026 0.20174019 0.80061207 0.60008995 0.7006423 0.70133933 0.75025857 0.99842586 0.99817603 ] } "library-prototype-label" { "source-value" "A2B_mP12_14_2e_e-003" } "short-name" { "source-value" "O2V binary oxide (R. Friedrich), ICSD #647610" } } ]