{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/c" } "basis-atom-coordinates" { "source-value" [ [ 0.95701 0.779585 0.814563 ] [ 0.45701 0.720415 0.814563 ] [ 0.54299 0.279585 0.185437 ] [ 0.04299 0.220415 0.185437 ] [ 0.744885 0.266136 0.650562 ] [ 0.244885 0.233864 0.650562 ] [ 0.755115 0.766136 0.349438 ] [ 0.255115 0.733864 0.349438 ] [ 0.81392 0.932741 0.544341 ] [ 0.31392 0.567259 0.544341 ] [ 0.68608 0.432741 0.455659 ] [ 0.18608 0.067259 0.455659 ] [ 0.847255 0.105445 0.865538 ] [ 0.347255 0.394555 0.865538 ] [ 0.703992 0.573708 0.785227 ] [ 0.203992 0.926292 0.785227 ] [ 0.507628 0.094945 0.676314 ] [ 0.007628 0.405055 0.676314 ] [ 0.992372 0.594945 0.323686 ] [ 0.492372 0.905055 0.323686 ] [ 0.796008 0.073708 0.214773 ] [ 0.296008 0.426292 0.214773 ] [ 0.652745 0.605445 0.134462 ] [ 0.152745 0.894555 0.134462 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "V" "V" "V" "V" "O" "O" "O" "O" "F" "F" "F" "F" "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" 7.32525237 "source-unit" "angstrom" } "b" { "source-value" 5.06959984 "source-unit" "angstrom" } "c" { "source-value" 7.90143517 "source-unit" "angstrom" } "beta" { "source-value" 100.79134034 "source-unit" "degree" } }