{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmmn" } "basis-atom-coordinates" { "source-value" [ [ 0.5 0 0.260573 ] [ 0 0.5 0.739427 ] [ 0 0.702717 0.121918 ] [ 0 0.297283 0.121918 ] [ 0.5 0.202717 0.878082 ] [ 0.5 0.797283 0.878082 ] [ 0.5 0.5 0.385212 ] [ 0 0 0.614788 ] [ 0 0.288888 0.418373 ] [ 0.5 0.5 0.070766 ] [ 0 0 0.929234 ] [ 0.5 0.211112 0.581627 ] [ 0.5 0.788888 0.581627 ] [ 0 0.711112 0.418373 ] ] } "species" { "source-value" [ "K" "K" "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" "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" 4.78822689 "source-unit" "angstrom" } "b" { "source-value" 7.818447 "source-unit" "angstrom" } "c" { "source-value" 9.49225517 "source-unit" "angstrom" } }