{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-hexagonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P6_3/m" } "basis-atom-coordinates" { "source-value" [ [ 0.828903 0.235162 0.75 ] [ 0.593741 0.828903 0.25 ] [ 0.235162 0.406259 0.25 ] [ 0.764838 0.593741 0.75 ] [ 0.406259 0.171097 0.75 ] [ 0.171097 0.764838 0.25 ] [ 0.666667 0.333333 0.75 ] [ 0.333333 0.666667 0.25 ] [ 0.669576 0.972326 0.75 ] [ 0.69725 0.669576 0.25 ] [ 0.972326 0.30275 0.25 ] [ 0.027674 0.69725 0.75 ] [ 0.330424 0.027674 0.25 ] [ 0.30275 0.330424 0.75 ] ] } "species" { "source-value" [ "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "N" "N" "N" "N" "N" "N" "N" "N" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 8.12041169819 "source-unit" "angstrom" } "c" { "source-value" 3.1100557 "source-unit" "angstrom" } }