[ { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/binding-energy-crystal" "instance-id" 1 "prototype-label" { "source-value" "A3B4_cF56_216_abe_2e" } "stoichiometric-species" { "source-value" [ "Fe" "O" ] } "a" { "source-value" 9.4584 "source-unit" "angstrom" "si-unit" "m" "si-value" 9.4584e-10 } "parameter-names" { "source-value" [ "x3" "x4" "x5" ] } "parameter-values" { "source-value" [ 0.35354622 0.14139111 0.61100163 ] } "library-prototype-label" { "source-value" "A3B4_cF56_216_abe_2e-001" } "short-name" { "source-value" [ "metal-oxide; Fe3O4, ICSD #65338" ] } "binding-potential-energy-per-atom" { "source-value" -4.3133948574548935 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.91082045382999e-19 } "binding-potential-energy-per-formula" { "source-value" -30.193764002184253 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.837574317680993e-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" "A3B4_cF56_216_abe_2e" } "stoichiometric-species" { "source-value" [ "Fe" "O" ] } "a" { "source-value" 9.4584 "source-unit" "angstrom" "si-unit" "m" "si-value" 9.4584e-10 } "parameter-names" { "source-value" [ "x3" "x4" "x5" ] } "parameter-values" { "source-value" [ 0.35354622 0.14139111 0.61100163 ] } "library-prototype-label" { "source-value" "A3B4_cF56_216_abe_2e-001" } "short-name" { "source-value" [ "metal-oxide; Fe3O4, ICSD #65338" ] } "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" } } ]