[ { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/binding-energy-crystal" "instance-id" 1 "prototype-label" { "source-value" "AB3_tI8_139_a_bd" } "stoichiometric-species" { "source-value" [ "Fe" "Ni" ] } "a" { "source-value" 3.5372 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.5372e-10 } "parameter-names" { "source-value" [ "c/a" ] } "parameter-values" { "source-value" [ 2.0472125 ] } "library-prototype-label" { "source-value" "A3B_tI8_139_bd_a-002" } "short-name" { "source-value" [ "fcc derivative (Y. Lederer)" ] } "binding-potential-energy-per-atom" { "source-value" -4.367812881007595 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.99800773963459e-19 } "binding-potential-energy-per-formula" { "source-value" -17.47125152403038 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.799203095853836e-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" "AB3_tI8_139_a_bd" } "stoichiometric-species" { "source-value" [ "Fe" "Ni" ] } "a" { "source-value" 3.5372 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.5372e-10 } "parameter-names" { "source-value" [ "c/a" ] } "parameter-values" { "source-value" [ 2.0472125 ] } "library-prototype-label" { "source-value" "A3B_tI8_139_bd_a-002" } "short-name" { "source-value" [ "fcc derivative (Y. Lederer)" ] } "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" } } ]