{ "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" [ [ 0.438123 0.715158 0.542429 ] [ 0.061877 0.215158 0.457571 ] [ 0.938123 0.784842 0.542429 ] [ 0.561877 0.284842 0.457571 ] [ 0 0 0 ] [ 0.5 0.5 0 ] [ 0.13369 0.888264 0.380666 ] [ 0.661413 0.785724 0.870212 ] [ 0.36631 0.388264 0.619334 ] [ 0.838587 0.285724 0.129788 ] [ 0.161413 0.714276 0.870212 ] [ 0.63369 0.611736 0.380666 ] [ 0.338587 0.214276 0.129788 ] [ 0.86631 0.111736 0.619334 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Mn" "Mn" "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" 5.83866344 "source-unit" "angstrom" } "b" { "source-value" 5.53201454 "source-unit" "angstrom" } "c" { "source-value" 6.16362633 "source-unit" "angstrom" } "beta" { "source-value" 116.8459287 "source-unit" "degree" } }