{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_12_12_1" } "basis-atom-coordinates" { "source-value" [ [ 0.14014 0.115414 0.113796 ] [ 0.35986 0.884586 0.613796 ] [ 0.64014 0.384586 0.886204 ] [ 0.85986 0.615414 0.386204 ] [ 0.129153 0.704539 0.490353 ] [ 0.370847 0.295461 0.990353 ] [ 0.629153 0.795461 0.509647 ] [ 0.870847 0.204539 0.009647 ] [ 0.067657 0.423285 0.24221 ] [ 0.100835 0.93093 0.743659 ] [ 0.28306 0.180981 0.52394 ] [ 0.21694 0.819019 0.02394 ] [ 0.399165 0.06907 0.243659 ] [ 0.432343 0.576715 0.74221 ] [ 0.567657 0.076715 0.75779 ] [ 0.600835 0.56907 0.256341 ] [ 0.78306 0.319019 0.47606 ] [ 0.71694 0.680981 0.97606 ] [ 0.899165 0.43093 0.756341 ] [ 0.932343 0.923285 0.25779 ] ] } "species" { "source-value" [ "W" "W" "W" "W" "O" "O" "O" "O" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.4950029 "source-unit" "angstrom" } "b" { "source-value" 5.55847279 "source-unit" "angstrom" } "c" { "source-value" 9.546243 "source-unit" "angstrom" } }