{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2/c" } "basis-atom-coordinates" { "source-value" [ [ 0.25 0.114687 0.5 ] [ 0.25 0.641396 0.5 ] [ 0.25 0.37508 0 ] [ 0.75 0.358604 0.5 ] [ 0.75 0.885313 0.5 ] [ 0.75 0.62492 0 ] [ 0.25 0.901643 0 ] [ 0.75 0.098357 0 ] [ 0.003604 0.87078 0.237143 ] [ 0.496396 0.87078 0.762857 ] [ 0.503604 0.12922 0.237143 ] [ 0.996396 0.12922 0.762857 ] [ 0.007335 0.628676 0.755038 ] [ 0.507335 0.371324 0.755038 ] [ 0.492665 0.628676 0.244962 ] [ 0.992665 0.371324 0.244962 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "V" "V" "O" "O" "O" "O" "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" 5.01006188 "source-unit" "angstrom" } "b" { "source-value" 5.97059158 "source-unit" "angstrom" } "c" { "source-value" 5.11767737 "source-unit" "angstrom" } "beta" { "source-value" 107.76067125 "source-unit" "degree" } }