{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-hexagonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P3_221" } "basis-atom-coordinates" { "source-value" [ [ 0.24155 0.24155 0 ] [ 0 0.75845 0.333333 ] [ 0.75845 0 0.666667 ] [ 0.543488 0.543488 0.5 ] [ 0 0.456512 0.833333 ] [ 0.456512 0 0.166667 ] ] } "species" { "source-value" [ "Hg" "Hg" "Hg" "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" 4.43070868 "source-unit" "angstrom" } "c" { "source-value" 9.74559109 "source-unit" "angstrom" } }