{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pbnm" } "basis-atom-coordinates" { "source-value" [ [ 0.02167 0.936282 0.75 ] [ 0.47833 0.436282 0.75 ] [ 0.52167 0.563718 0.25 ] [ 0.97833 0.063718 0.25 ] [ 0 0.5 0 ] [ 0 0.5 0.5 ] [ 0.5 0 0 ] [ 0.5 0 0.5 ] [ 0.118876 0.451143 0.25 ] [ 0.19711 0.200294 0.563811 ] [ 0.19711 0.200294 0.936189 ] [ 0.30289 0.700294 0.936189 ] [ 0.30289 0.700294 0.563811 ] [ 0.381124 0.951143 0.25 ] [ 0.618876 0.048857 0.75 ] [ 0.69711 0.299706 0.436189 ] [ 0.69711 0.299706 0.063811 ] [ 0.80289 0.799706 0.063811 ] [ 0.80289 0.799706 0.436189 ] [ 0.881124 0.548857 0.75 ] ] } "species" { "source-value" [ "In" "In" "In" "In" "Co" "Co" "Co" "Co" "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" 5.12414189 "source-unit" "angstrom" } "b" { "source-value" 5.31383334 "source-unit" "angstrom" } "c" { "source-value" 7.43516932 "source-unit" "angstrom" } }