{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pc" } "basis-atom-coordinates" { "source-value" [ [ 0.249033 0.518222 0.980763 ] [ 0.249033 0.481778 0.480763 ] [ 0.470592 0.262109 0.814379 ] [ 0.470592 0.737891 0.314379 ] [ 0.737896 0.002538 0.540902 ] [ 0.737896 0.997462 0.040902 ] [ 0.998111 0.809058 0.799185 ] [ 0.998111 0.190942 0.299185 ] [ 0.256997 0.012363 0.596402 ] [ 0.256997 0.987637 0.096402 ] [ 0.746399 0.518825 0.899113 ] [ 0.746399 0.481175 0.399113 ] [ 0.008644 0.545636 0.88204 ] [ 0.008644 0.454364 0.38204 ] [ 0.235924 0.904091 0.843921 ] [ 0.235924 0.095909 0.343921 ] [ 0.245276 0.283052 0.657562 ] [ 0.245276 0.716948 0.157562 ] [ 0.299612 0.754904 0.517164 ] [ 0.299612 0.245096 0.017164 ] [ 0.486933 0.532674 0.876603 ] [ 0.486933 0.467326 0.376603 ] [ 0.510065 0.056117 0.639343 ] [ 0.510065 0.943883 0.139343 ] [ 0.708038 0.243591 0.93798 ] [ 0.708038 0.756409 0.43798 ] [ 0.760813 0.802668 0.861792 ] [ 0.760813 0.197332 0.361792 ] [ 0.74778 0.436759 0.649872 ] [ 0.74778 0.563241 0.149872 ] [ 0.99854 0.978015 0.596861 ] [ 0.99854 0.021985 0.096861 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "V" "V" "V" "V" "F" "F" "F" "F" "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" 7.48201575 "source-unit" "angstrom" } "b" { "source-value" 6.95050681 "source-unit" "angstrom" } "c" { "source-value" 7.81795253 "source-unit" "angstrom" } "beta" { "source-value" 90.5977648 "source-unit" "degree" } }