{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pnnm" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] [ 0 0 0.332217 ] [ 0.5 0.5 0.832217 ] [ 0.5 0.5 0.167783 ] [ 0 0 0.667783 ] [ 0.303893 0.684984 0 ] [ 0.295918 0.693897 0.328388 ] [ 0.196107 0.184984 0.5 ] [ 0.204082 0.193897 0.828388 ] [ 0.295918 0.693897 0.671612 ] [ 0.795918 0.806103 0.828388 ] [ 0.696107 0.315016 0 ] [ 0.704082 0.306103 0.671612 ] [ 0.803893 0.815016 0.5 ] [ 0.204082 0.193897 0.171612 ] [ 0.704082 0.306103 0.328388 ] [ 0.795918 0.806103 0.171612 ] ] } "species" { "source-value" [ "Cu" "Cu" "Sb" "Sb" "Sb" "Sb" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.71251187832 "source-unit" "angstrom" } "b" { "source-value" 4.7502865 "source-unit" "angstrom" } "c" { "source-value" 9.40125485891 "source-unit" "angstrom" } }