{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Im2m" } "basis-atom-coordinates" { "source-value" [ [ 0 0.959241 0 ] [ 0.5 0.459241 0.5 ] [ 0 0.508188 0 ] [ 0.5 0.008188 0.5 ] [ 0.5 0.013097 0.129014 ] [ 0.5 0.013097 0.870986 ] [ 0 0.513097 0.629014 ] [ 0 0.513097 0.370986 ] ] } "species" { "source-value" [ "V" "V" "O" "O" "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" 3.08566689 "source-unit" "angstrom" } "b" { "source-value" 3.73424415 "source-unit" "angstrom" } "c" { "source-value" 9.67387736 "source-unit" "angstrom" } }