{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1am" } "basis-atom-coordinates" { "source-value" [ [ 0.02502 0.972901 0 ] [ 0.97498 0.472901 0 ] [ 0.99577 0.959195 0.717404 ] [ 0.99577 0.959195 0.282596 ] [ 0.00423 0.459195 0.717404 ] [ 0.00423 0.459195 0.282596 ] [ 0.507336 0.968634 0 ] [ 0.998134 0.717195 0 ] [ 0.492664 0.468634 0 ] [ 0.001866 0.217195 0 ] ] } "species" { "source-value" [ "W" "W" "Br" "Br" "Br" "Br" "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" 3.86961927 "source-unit" "angstrom" } "b" { "source-value" 7.70784688 "source-unit" "angstrom" } "c" { "source-value" 8.82386212 "source-unit" "angstrom" } }