{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cmcm" } "basis-atom-coordinates" { "source-value" [ [ 0 0.034735 0.25 ] [ 0 0.965265 0.75 ] [ 0.5 0.534735 0.25 ] [ 0.5 0.465265 0.75 ] [ 0 0 0.5 ] [ 0 0 0 ] [ 0.750696 0.237095 0.75 ] [ 0.249304 0.237095 0.75 ] [ 0.249304 0.762905 0.25 ] [ 0.750696 0.762905 0.25 ] [ 0.5 0.5 0.5 ] [ 0.5 0.5 0 ] [ 0.250696 0.737095 0.75 ] [ 0.749304 0.737095 0.75 ] [ 0.749304 0.262905 0.25 ] [ 0.250696 0.262905 0.25 ] ] } "species" { "source-value" [ "W" "W" "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" 5.49361349517 "source-unit" "angstrom" } "b" { "source-value" 5.49526066079 "source-unit" "angstrom" } "c" { "source-value" 7.68169069 "source-unit" "angstrom" } }