{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-hexagonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P3_2" } "basis-atom-coordinates" { "source-value" [ [ 0.985906 0.461916 0.328176 ] [ 0.538084 0.52399 0.994842 ] [ 0.47601 0.014094 0.661509 ] [ 0.388331 0.260582 0.782152 ] [ 0.872251 0.611669 0.115486 ] [ 0.739418 0.127749 0.448819 ] [ 0.146478 0.720287 0.556338 ] [ 0.279713 0.426191 0.223005 ] [ 0.573809 0.853522 0.889671 ] ] } "species" { "source-value" [ "P" "P" "P" "N" "N" "N" "O" "O" "O" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.78361177503 "source-unit" "angstrom" } "c" { "source-value" 5.28120664 "source-unit" "angstrom" } }