{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Imm2" } "basis-atom-coordinates" { "source-value" [ [ 0.5 0.239529 0.858464 ] [ 0 0.373209 0 ] [ 0.5 0.239529 0.141536 ] [ 0 0.739529 0.358464 ] [ 0.5 0.873209 0.5 ] [ 0 0.739529 0.641536 ] [ 0.5 0.591599 0.158313 ] [ 0.5 0.918532 0.151961 ] [ 0.5 0.591599 0.841687 ] [ 0.5 0.918532 0.848039 ] [ 0 0.091599 0.658313 ] [ 0 0.418532 0.651961 ] [ 0 0.091599 0.341687 ] [ 0 0.418532 0.348039 ] [ 0 0.259298 0.794294 ] [ 0.5 0.442515 0 ] [ 0.5 0.064535 0 ] [ 0 0.259298 0.205706 ] [ 0.5 0.759298 0.294294 ] [ 0 0.942515 0.5 ] [ 0 0.564535 0.5 ] [ 0.5 0.759298 0.705706 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Cu" "Cu" "Cu" "Cu" "Cu" "Cu" "Cu" "Cu" "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" 3.73006202 "source-unit" "angstrom" } "b" { "source-value" 8.39148315 "source-unit" "angstrom" } "c" { "source-value" 8.75254827 "source-unit" "angstrom" } }