{ "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" [ [ 0.74985 0.501576 0.883005 ] [ 0.5 0 1 ] [ 0.5 0 0.5 ] [ 0.997583 0.003353 0.250918 ] [ 0.25015 0.498424 0.116995 ] [ 0.002417 0.996647 0.749082 ] [ 0.735059 0.483404 0.382929 ] [ 0.264941 0.516596 0.617071 ] [ 0.885102 0.761593 0.567362 ] [ 0.114898 0.238407 0.432638 ] [ 0.872898 0.747997 0.061574 ] [ 0.621872 0.245922 0.176209 ] [ 0.636205 0.264133 0.703138 ] [ 0.127102 0.252003 0.938426 ] [ 0.378128 0.754078 0.823791 ] [ 0.363795 0.735867 0.296862 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Fe" "Fe" "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" 2.99541891 "source-unit" "angstrom" } "b" { "source-value" 5.17636567 "source-unit" "angstrom" } "c" { "source-value" 10.37706041 "source-unit" "angstrom" } "alpha" { "source-value" 100.37329118 "source-unit" "degree" } "beta" { "source-value" 89.87635864 "source-unit" "degree" } "gamma" { "source-value" 106.6427505 "source-unit" "degree" } }