[ { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/binding-energy-crystal" "instance-id" 1 "prototype-label" { "source-value" "A2B_mP12_4_4a_2a" } "stoichiometric-species" { "source-value" [ "O" "Si" ] } "a" { "source-value" 4.9638 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.9638e-10 } "binding-potential-energy-per-atom" { "source-value" -6.464368406611661 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.035706001464101e-18 } "binding-potential-energy-per-formula" { "source-value" -19.393105219834982 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.107118004392304e-18 } "parameter-names" { "source-value" [ "b/a" "c/a" "beta" "x1" "y1" "z1" "x2" "y2" "z2" "x3" "y3" "z3" "x4" "y4" "z4" "x5" "y5" "z5" "x6" "y6" "z6" ] } "parameter-values" { "source-value" [ 1.5911801 0.93196744 117.8294 0.26983152 0.75099687 0.63402973 0.41590001 0.062397089 0.85141121 0.0011036655 0.00050634224 0.2440959 0.58670058 0.93931481 0.43672569 0.32078457 0.93945897 0.54217712 0.3179534 0.56242593 0.77685802 ] } } { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/crystal-structure-npt" "instance-id" 2 "prototype-label" { "source-value" "A2B_mP12_4_4a_2a" } "stoichiometric-species" { "source-value" [ "O" "Si" ] } "a" { "source-value" 4.9638 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.9638e-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" "beta" "x1" "y1" "z1" "x2" "y2" "z2" "x3" "y3" "z3" "x4" "y4" "z4" "x5" "y5" "z5" "x6" "y6" "z6" ] } "parameter-values" { "source-value" [ 1.5911801 0.93196744 117.8294 0.26983152 0.75099687 0.63402973 0.41590001 0.062397089 0.85141121 0.0011036655 0.00050634224 0.2440959 0.58670058 0.93931481 0.43672569 0.32078457 0.93945897 0.54217712 0.3179534 0.56242593 0.77685802 ] } } ]