{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Imma" } "basis-atom-coordinates" { "source-value" [ [ 0.5 0.25 0.961932 ] [ 0.5 0.75 0.038068 ] [ 0 0.75 0.461932 ] [ 0 0.25 0.538068 ] [ 0 0.951905 0.834531 ] [ 0 0.048095 0.165469 ] [ 0.5 0.951905 0.665469 ] [ 0.5 0.048095 0.334531 ] [ 0.5 0.451905 0.334531 ] [ 0.5 0.548095 0.665469 ] [ 0 0.451905 0.165469 ] [ 0 0.548095 0.834531 ] ] } "species" { "source-value" [ "Nd" "Nd" "Nd" "Nd" "Cu" "Cu" "Cu" "Cu" "Cu" "Cu" "Cu" "Cu" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.36252277717 "source-unit" "angstrom" } "b" { "source-value" 7.06999872393 "source-unit" "angstrom" } "c" { "source-value" 7.47484187701 "source-unit" "angstrom" } }