{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1" } "basis-atom-coordinates" { "source-value" [ [ 0.764817 0.514186 0.223879 ] [ 0.235183 0.014186 0.776121 ] [ 0.201803 0.234085 0.343776 ] [ 0.798197 0.734085 0.656224 ] [ 0.275235 0.740158 0.438045 ] [ 0.724765 0.240158 0.561955 ] [ 0.277641 0.25654 0.080114 ] [ 0.722359 0.75654 0.919886 ] [ 0.68982 0.755489 0.053137 ] [ 0.056876 0.250418 0.140172 ] [ 0.45334 0.259529 0.188839 ] [ 0.213644 0.953103 0.341364 ] [ 0.205149 0.540125 0.337667 ] [ 0.894821 0.254367 0.416498 ] [ 0.568999 0.744149 0.498098 ] [ 0.431001 0.244149 0.501902 ] [ 0.105179 0.754367 0.583502 ] [ 0.794851 0.040125 0.662333 ] [ 0.786356 0.453103 0.658636 ] [ 0.54666 0.759529 0.811161 ] [ 0.943124 0.750418 0.859828 ] [ 0.31018 0.255489 0.946863 ] ] } "species" { "source-value" [ "Na" "Na" "V" "V" "Si" "Si" "C" "C" "O" "O" "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" 5.4077408 "source-unit" "angstrom" } "b" { "source-value" 6.42612941 "source-unit" "angstrom" } "c" { "source-value" 9.06236742 "source-unit" "angstrom" } "beta" { "source-value" 93.26367925 "source-unit" "degree" } }