{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-triclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P-1" } "basis-atom-coordinates" { "source-value" [ [ 0.669677 0.180444 0.397898 ] [ 0.330323 0.819556 0.602102 ] [ 0.9034 0.245125 0.966387 ] [ 0.350451 0.380127 0.763962 ] [ 0.649549 0.619872 0.236038 ] [ 0.0966 0.754875 0.033613 ] [ 0 0 0 ] [ 0.733995 0.524877 0.94803 ] [ 0.266005 0.475123 0.05197 ] [ 0.488057 0.109084 0.802928 ] [ 0.954265 0.206541 0.666071 ] [ 0.3807 0.285224 0.482674 ] [ 0.802986 0.349185 0.250818 ] [ 0.197014 0.650815 0.749182 ] [ 0.6193 0.714776 0.517326 ] [ 0.045735 0.793459 0.333929 ] [ 0.511943 0.890916 0.197072 ] ] } "species" { "source-value" [ "Li" "Li" "V" "V" "V" "V" "O" "O" "O" "F" "F" "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" 5.14845044 "source-unit" "angstrom" } "b" { "source-value" 6.59510016 "source-unit" "angstrom" } "c" { "source-value" 6.88974491 "source-unit" "angstrom" } "alpha" { "source-value" 107.94249047 "source-unit" "degree" } "beta" { "source-value" 105.38025173 "source-unit" "degree" } "gamma" { "source-value" 96.80875501 "source-unit" "degree" } }