{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2/c" } "basis-atom-coordinates" { "source-value" [ [ 0.5 0.674161 0.25 ] [ 0.5 0.325839 0.75 ] [ 0 0.172076 0.25 ] [ 0 0.827924 0.75 ] [ 0.25361 0.628764 0.893195 ] [ 0.74639 0.628764 0.606805 ] [ 0.74639 0.371236 0.106805 ] [ 0.25361 0.371236 0.393195 ] [ 0.209833 0.104798 0.938705 ] [ 0.790167 0.104798 0.561295 ] [ 0.790167 0.895202 0.061295 ] [ 0.209833 0.895202 0.438705 ] ] } "species" { "source-value" [ "Mn" "Mn" "W" "W" "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" 4.8831253924 "source-unit" "angstrom" } "b" { "source-value" 5.85448006 "source-unit" "angstrom" } "c" { "source-value" 5.12050263012 "source-unit" "angstrom" } "beta" { "source-value" 91.6578733484 "source-unit" "degree" } }