{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pm" } "basis-atom-coordinates" { "source-value" [ [ 0.83187 0.5 0.666327 ] [ 0.18381 0.5 0.332316 ] [ 0.506469 0.5 0.99508 ] [ 0.66558 0 0.329047 ] [ 0.315993 0 0.667014 ] [ 0.990612 0 0.001398 ] [ 0.775236 0.5 0.414522 ] [ 0.46408 0.5 0.2264 ] [ 0.478792 0.5 0.71905 ] [ 0.795221 0.5 0.91168 ] [ 0.130741 0.5 0.068483 ] [ 0.144109 0.5 0.559704 ] [ 0.369579 0 0.924293 ] [ 0.702089 0 0.101841 ] [ 0.034333 0 0.277281 ] [ 0.026119 0 0.768275 ] [ 0.388098 0 0.438656 ] ] } "species" { "source-value" [ "Y" "Zr" "Zr" "Zr" "Zr" "Zr" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 6.57055068 "source-unit" "angstrom" } "b" { "source-value" 3.57782671 "source-unit" "angstrom" } "c" { "source-value" 9.07689319 "source-unit" "angstrom" } "beta" { "source-value" 90.26110015 "source-unit" "degree" } }