{ "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" [ [ 0.056961 0 0.128877 ] [ 0.174613 0 0.734192 ] [ 0.323701 0.5 0.229453 ] [ 0.426543 0.5 0.642592 ] [ 0.564806 0 0.367837 ] [ 0.687501 0 0.756862 ] [ 0.811912 0.5 0.255348 ] [ 0.942819 0.5 0.864735 ] [ 0.108807 0 0.427479 ] [ 0.402459 0.5 0.933178 ] [ 0.597416 0 0.067956 ] [ 0.876805 0.5 0.567959 ] [ 0.069763 0.5 0.451474 ] [ 0.44652 0 0.954178 ] [ 0.551904 0.5 0.049816 ] [ 0.666988 0.5 0.509202 ] [ 0.056233 0.5 0.187227 ] [ 0.130599 0.5 0.645488 ] [ 0.154005 0.5 0.98322 ] [ 0.239284 0 0.318728 ] [ 0.256318 0.5 0.821587 ] [ 0.358421 0 0.481368 ] [ 0.36529 0 0.14307 ] [ 0.441807 0 0.691569 ] [ 0.55263 0.5 0.306951 ] [ 0.635626 0.5 0.862404 ] [ 0.744575 0 0.181851 ] [ 0.747757 0.5 0.685632 ] [ 0.846128 0 0.019705 ] [ 0.863374 0 0.359176 ] [ 0.954124 0 0.558805 ] [ 0.944312 0 0.812083 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "V" "V" "V" "V" "O" "O" "O" "O" "F" "F" "F" "F" "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" 6.74449182 "source-unit" "angstrom" } "b" { "source-value" 3.7352592 "source-unit" "angstrom" } "c" { "source-value" 14.70810437 "source-unit" "angstrom" } "beta" { "source-value" 90.79933724 "source-unit" "degree" } }