{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "I4/m" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] [ 0.301076 0.901312 0.5 ] [ 0.698924 0.098688 0.5 ] [ 0.901312 0.698924 0.5 ] [ 0.098688 0.301076 0.5 ] [ 0.801076 0.401312 0 ] [ 0.198924 0.598688 0 ] [ 0.401312 0.198924 0 ] [ 0.598688 0.801076 0 ] ] } "species" { "source-value" [ "Ho" "Ho" "Au" "Au" "Au" "Au" "Au" "Au" "Au" "Au" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 6.79628854641 "source-unit" "angstrom" } "c" { "source-value" 4.22629831458 "source-unit" "angstrom" } }