{ "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" [ [ 0.713211 0.228295 0.094045 ] [ 0.786789 0.728295 0.405955 ] [ 0.286789 0.771705 0.905955 ] [ 0.213211 0.271705 0.594045 ] [ 0.187424 0.487696 0.116634 ] [ 0.312576 0.987696 0.383366 ] [ 0.812576 0.512304 0.883366 ] [ 0.687424 0.012304 0.616634 ] [ 0.675532 0.374231 0.389037 ] [ 0.824468 0.874231 0.110963 ] [ 0.324468 0.625769 0.610963 ] [ 0.175532 0.125769 0.889037 ] ] } "species" { "source-value" [ "La" "La" "La" "La" "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" 4.54760250762 "source-unit" "angstrom" } "b" { "source-value" 8.41530483 "source-unit" "angstrom" } "c" { "source-value" 9.17889918501 "source-unit" "angstrom" } "beta" { "source-value" 99.9700063896 "source-unit" "degree" } }