{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/c" } "basis-atom-coordinates" { "source-value" [ [ 0.628919 0.695538 0.903335 ] [ 0.371081 0.304462 0.096665 ] [ 0.628919 0.804462 0.403335 ] [ 0.371081 0.195538 0.596665 ] [ 0.159278 0.77665 0.115636 ] [ 0.159278 0.72335 0.615636 ] [ 0.840722 0.22335 0.884364 ] [ 0.840722 0.27665 0.384364 ] [ 0.961161 0.448242 0.302263 ] [ 0.038839 0.948242 0.197737 ] [ 0.961161 0.051758 0.802263 ] [ 0.038839 0.551758 0.697737 ] [ 0.237923 0.663955 0.061212 ] [ 0.237923 0.836045 0.561212 ] [ 0.762077 0.163955 0.438788 ] [ 0.762077 0.336045 0.938788 ] ] } "species" { "source-value" [ "K" "K" "K" "K" "C" "C" "C" "C" "Se" "Se" "Se" "Se" "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" 4.60398548151 "source-unit" "angstrom" } "b" { "source-value" 7.75116355122 "source-unit" "angstrom" } "c" { "source-value" 12.0349837773 "source-unit" "angstrom" } "beta" { "source-value" 100.342727698 "source-unit" "degree" } }