{ "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 0.5 0.114166 ] [ 0 0 0.885834 ] [ 0 0.5 0.92773 ] [ 0.5 0 0.07227 ] [ 0.5 0 0.686776 ] [ 0 0.5 0.313224 ] ] } "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" 3.95728908 "source-unit" "angstrom" } "b" { "source-value" 5.2718977 "source-unit" "angstrom" } "c" { "source-value" 9.74130204 "source-unit" "angstrom" } }