{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmmn" } "basis-atom-coordinates" { "source-value" [ [ 0.5 0 0.809427 ] [ 0 0.5 0.190573 ] [ 0.5 0.5 0.361868 ] [ 0 0 0.638132 ] [ 0 0 0.094619 ] [ 0.5 0.5 0.905381 ] ] } "species" { "source-value" [ "Lu" "Lu" "S" "S" "Br" "Br" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.97652302 "source-unit" "angstrom" } "b" { "source-value" 5.63539233 "source-unit" "angstrom" } "c" { "source-value" 8.34777298 "source-unit" "angstrom" } }