{ "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" [ [ 0.626675 0.278092 0.274533 ] [ 0.373325 0.721908 0.725467 ] [ 0.873325 0.778092 0.725467 ] [ 0.126675 0.221908 0.274533 ] [ 0.881521 0.316635 0.99799 ] [ 0.874754 0.756925 0.367742 ] [ 0.381521 0.183365 0.99799 ] [ 0.618479 0.816635 0.00201 ] [ 0.625246 0.256925 0.632258 ] [ 0.118479 0.683365 0.00201 ] [ 0.374754 0.743075 0.367742 ] [ 0.125246 0.243075 0.632258 ] ] } "species" { "source-value" [ "Pr" "Pr" "Pr" "Pr" "Se" "Se" "Se" "Se" "Se" "Se" "Se" "Se" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 8.48764365423 "source-unit" "angstrom" } "b" { "source-value" 4.22772978 "source-unit" "angstrom" } "c" { "source-value" 8.61260293954 "source-unit" "angstrom" } "beta" { "source-value" 90.201926522 "source-unit" "degree" } }