{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pnma" } "basis-atom-coordinates" { "source-value" [ [ 0.982249 0.062833 0.25 ] [ 0.482249 0.437167 0.75 ] [ 0.517751 0.562833 0.25 ] [ 0.017751 0.937167 0.75 ] [ 0.5 0 0 ] [ 0.5 0 0.5 ] [ 0 0.5 0 ] [ 0 0.5 0.5 ] [ 0.626894 0.057997 0.75 ] [ 0.187429 0.19059 0.563991 ] [ 0.187429 0.19059 0.936009 ] [ 0.687429 0.30941 0.063991 ] [ 0.687429 0.30941 0.436009 ] [ 0.126894 0.442003 0.25 ] [ 0.873106 0.557997 0.75 ] [ 0.312571 0.69059 0.936009 ] [ 0.312571 0.69059 0.563991 ] [ 0.812571 0.80941 0.063991 ] [ 0.812571 0.80941 0.436009 ] [ 0.373106 0.942003 0.25 ] ] } "species" { "source-value" [ "Nd" "Nd" "Nd" "Nd" "In" "In" "In" "In" "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" 5.68167575 "source-unit" "angstrom" } "b" { "source-value" 6.00380785 "source-unit" "angstrom" } "c" { "source-value" 8.24042082 "source-unit" "angstrom" } }