{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "C2" } "basis-atom-coordinates" { "source-value" [ [ 0.159055 0.905924 0.53303 ] [ 0.840945 0.905924 0.46697 ] [ 0.867457 0.35592 0.113096 ] [ 0.132543 0.35592 0.886904 ] [ 0.659055 0.405924 0.53303 ] [ 0.340945 0.405924 0.46697 ] [ 0.367457 0.85592 0.113096 ] [ 0.632543 0.85592 0.886904 ] [ 0 0.775158 0 ] [ 0.5 0.275158 0 ] [ 0.083118 0.926449 0.888554 ] [ 0.916882 0.926449 0.111446 ] [ 0.885566 0.615358 0.787132 ] [ 0.114434 0.615358 0.212868 ] [ 0.583118 0.426449 0.888554 ] [ 0.416882 0.426449 0.111446 ] [ 0.385566 0.115358 0.787132 ] [ 0.614434 0.115358 0.212868 ] ] } "species" { "source-value" [ "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "C" "C" "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" 9.17532006339 "source-unit" "angstrom" } "b" { "source-value" 5.31228189059 "source-unit" "angstrom" } "c" { "source-value" 5.46060623727 "source-unit" "angstrom" } "beta" { "source-value" 116.761959445 "source-unit" "degree" } }