{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P-42m" } "basis-atom-coordinates" { "source-value" [ [ 0 0.5 0 ] [ 0.5 0 0 ] [ 0 0 0 ] [ 0.21312 0.78688 0.229845 ] [ 0.21312 0.21312 0.770155 ] [ 0.78688 0.78688 0.770155 ] [ 0.78688 0.21312 0.229845 ] ] } "species" { "source-value" [ "Li" "Li" "W" "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" 6.06981316 "source-unit" "angstrom" } "c" { "source-value" 5.45009043 "source-unit" "angstrom" } }