{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pnmm" } "basis-atom-coordinates" { "source-value" [ [ 0.558209 0.25 0.25 ] [ 0.441791 0.75 0.75 ] [ 0.828016 0.75 0.996852 ] [ 0.828016 0.75 0.503148 ] [ 0.171984 0.25 0.003148 ] [ 0.171984 0.25 0.496852 ] [ 0.33279 0.75 0.128057 ] [ 0.33279 0.75 0.371943 ] [ 0.040061 0.518299 0.25 ] [ 0.040061 0.981701 0.25 ] [ 0.959939 0.018299 0.75 ] [ 0.959939 0.481701 0.75 ] [ 0.66721 0.25 0.628057 ] [ 0.66721 0.25 0.871943 ] [ 0.687282 0.75 0.25 ] [ 0.312718 0.25 0.75 ] ] } "species" { "source-value" [ "K" "K" "K" "K" "K" "K" "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" "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" 6.66675844 "source-unit" "angstrom" } "b" { "source-value" 6.94496658 "source-unit" "angstrom" } "c" { "source-value" 12.88316501 "source-unit" "angstrom" } }