{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "C2mm" } "basis-atom-coordinates" { "source-value" [ [ 0.251686 0.753235 0.249957 ] [ 0.251686 0.253235 0.250043 ] [ 0.748314 0.753235 0.249957 ] [ 0.748314 0.253235 0.250043 ] [ 0.251686 0.253235 0.749957 ] [ 0.251686 0.753235 0.750043 ] [ 0.748314 0.253235 0.749957 ] [ 0.748314 0.753235 0.750043 ] [ 0.751421 0.499197 0.5 ] [ 0.248579 0.499197 0.5 ] [ 0.751421 0.999197 0 ] [ 0.248579 0.999197 0 ] [ 0.5 0.272597 0.5 ] [ 0 0.504296 0.271668 ] [ 0 0.004296 0.228332 ] [ 0.5 0.228144 0 ] [ 0.5 0.772597 0 ] [ 0 0.004296 0.771668 ] [ 0 0.504296 0.728332 ] [ 0.5 0.728144 0.5 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Cu" "Cu" "Cu" "Cu" "S" "S" "S" "S" "S" "S" "S" "S" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.80595841 "source-unit" "angstrom" } "b" { "source-value" 7.89443171 "source-unit" "angstrom" } "c" { "source-value" 7.9420281 "source-unit" "angstrom" } }