{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pc" } "basis-atom-coordinates" { "source-value" [ [ 0.086478 0.253236 0.959885 ] [ 0.586478 0.746764 0.959885 ] [ 0.185412 0.756159 0.458877 ] [ 0.685412 0.243841 0.458877 ] [ 0.97516 0.483386 0.489744 ] [ 0.47516 0.516614 0.489744 ] [ 0.330147 0.502165 0.009072 ] [ 0.830147 0.497835 0.009072 ] [ 0.550657 0.733213 0.796039 ] [ 0.050657 0.266787 0.796039 ] [ 0.459183 0.007303 0.51332 ] [ 0.959183 0.992697 0.51332 ] [ 0.143588 0.788192 0.295909 ] [ 0.643588 0.211808 0.295909 ] [ 0.320576 0.992183 0.997955 ] [ 0.820576 0.007817 0.997955 ] ] } "species" { "source-value" [ "Mo" "Mo" "Mo" "Mo" "O" "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" 5.30810377 "source-unit" "angstrom" } "b" { "source-value" 5.28101649 "source-unit" "angstrom" } "c" { "source-value" 10.4767324 "source-unit" "angstrom" } "beta" { "source-value" 97.01922884 "source-unit" "degree" } }