{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P4_2/mnm" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0.666189 ] [ 0.5 0.5 0.166189 ] [ 0.5 0.5 0.833811 ] [ 0 0 0.333811 ] [ 0.5 0.5 0.5 ] [ 0 0 0 ] [ 0.696069 0.696069 0.658863 ] [ 0.303931 0.303931 0.658863 ] [ 0.696069 0.696069 0.341137 ] [ 0.196069 0.803931 0.158863 ] [ 0.803931 0.196069 0.158863 ] [ 0.803931 0.196069 0.841137 ] [ 0.294278 0.294278 0 ] [ 0.205722 0.794278 0.5 ] [ 0.794278 0.205722 0.5 ] [ 0.196069 0.803931 0.841137 ] [ 0.303931 0.303931 0.341137 ] [ 0.705722 0.705722 0 ] ] } "species" { "source-value" [ "V" "V" "V" "V" "W" "W" "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" 4.69122644 "source-unit" "angstrom" } "c" { "source-value" 9.21137095 "source-unit" "angstrom" } }