{ "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" [ [ 0.63245 0.89433 0.590542 ] [ 0.36755 0.10567 0.409458 ] [ 0.63245 0.60567 0.090542 ] [ 0.36755 0.39433 0.909458 ] [ 0.02247 0.373252 0.242533 ] [ 0.97753 0.626748 0.757467 ] [ 0.02247 0.126748 0.742533 ] [ 0.97753 0.873252 0.257467 ] [ 0.375857 0.640416 0.421711 ] [ 0.375857 0.859584 0.921711 ] [ 0.624143 0.359584 0.578289 ] [ 0.624143 0.140416 0.078289 ] [ 0.259466 0.862319 0.597762 ] [ 0.740534 0.362319 0.902238 ] [ 0.721824 0.888516 0.930694 ] [ 0.740534 0.137681 0.402238 ] [ 0.721824 0.611484 0.430694 ] [ 0.278176 0.111484 0.069306 ] [ 0.278176 0.388516 0.569306 ] [ 0.259466 0.637681 0.097762 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Ca" "Ca" "Ca" "Ca" "Ga" "Ga" "Ga" "Ga" "N" "N" "N" "N" "N" "N" "N" "N" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.82076593477 "source-unit" "angstrom" } "b" { "source-value" 6.97422657 "source-unit" "angstrom" } "c" { "source-value" 5.93660751389 "source-unit" "angstrom" } "beta" { "source-value" 90.0720865098 "source-unit" "degree" } }