{ "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 0.144458 0.75 ] [ 0 0.855542 0.25 ] [ 0.5 0.644458 0.75 ] [ 0.5 0.355542 0.25 ] [ 0.5 0.929234 0.75 ] [ 0.5 0.070766 0.25 ] [ 0 0.429234 0.75 ] [ 0 0.570766 0.25 ] ] } "species" { "source-value" [ "Th" "Th" "Th" "Th" "Al" "Al" "Al" "Al" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.46300261277 "source-unit" "angstrom" } "b" { "source-value" 11.4533782748 "source-unit" "angstrom" } "c" { "source-value" 4.18437217 "source-unit" "angstrom" } }