{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pm" } "basis-atom-coordinates" { "source-value" [ [ 0.185877 0 0.699194 ] [ 0.80902 0.5 0.312402 ] [ 0.13548 0.5 0.940849 ] [ 0.316275 0.5 0.461999 ] [ 0.244223 0.5 0.188087 ] [ 0.735041 0 0.798874 ] [ 0.683818 0 0.53878 ] [ 0.889918 0 0.084063 ] [ 0.038669 0 0.919635 ] [ 0.143715 0.5 0.326435 ] [ 0.19411 0 0.173071 ] [ 0.494657 0 0.721624 ] [ 0.384392 0 0.48244 ] [ 0.351511 0.5 0.049989 ] [ 0.614121 0.5 0.519131 ] [ 0.86416 0 0.670182 ] [ 0.77569 0 0.188987 ] [ 0.969568 0.5 0.06495 ] [ 0.209289 0.5 0.801937 ] [ 0.173041 0.5 0.574505 ] [ 0.658045 0 0.948052 ] [ 0.50741 0.5 0.285763 ] [ 0.796922 0.5 0.824717 ] [ 0.825046 0 0.424334 ] ] } "species" { "source-value" [ "Li" "Li" "V" "V" "V" "V" "V" "V" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "F" "F" "F" "F" "F" "F" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 6.66311893 "source-unit" "angstrom" } "b" { "source-value" 3.79006378 "source-unit" "angstrom" } "c" { "source-value" 12.24968704 "source-unit" "angstrom" } "beta" { "source-value" 104.11509718 "source-unit" "degree" } }