{ "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" [ [ 0.346403 0.740338 0.451216 ] [ 0.653597 0.740338 0.548784 ] [ 0.846403 0.240338 0.451216 ] [ 0.153597 0.240338 0.548784 ] [ 0.5 0.237921 0.5 ] [ 0.963803 0.502426 0.050081 ] [ 0.036197 0.502426 0.949919 ] [ 0.14946 0.22405 0.988737 ] [ 0.85054 0.22405 0.011263 ] [ 0 0.737921 0.5 ] [ 0.463803 0.002426 0.050081 ] [ 0.536197 0.002426 0.949919 ] [ 0.64946 0.72405 0.988737 ] [ 0.35054 0.72405 0.011263 ] [ 0 0.007148 0 ] [ 0.135548 0.743788 0.867486 ] [ 0.864452 0.743788 0.132514 ] [ 0.5 0.507148 0 ] [ 0.635548 0.243788 0.867486 ] [ 0.364452 0.243788 0.132514 ] ] } "species" { "source-value" [ "Ca" "Ca" "Ca" "Ca" "B" "B" "B" "B" "B" "B" "B" "B" "B" "B" "Os" "Os" "Os" "Os" "Os" "Os" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 13.392345443 "source-unit" "angstrom" } "b" { "source-value" 4.07167690182 "source-unit" "angstrom" } "c" { "source-value" 7.95885148422 "source-unit" "angstrom" } "beta" { "source-value" 139.021737637 "source-unit" "degree" } }