{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "C2/m" } "basis-atom-coordinates" { "source-value" [ [ 0 0.334032 0 ] [ 0 0.665968 0 ] [ 0.5 0.834032 0 ] [ 0.5 0.165968 0 ] [ 0.5 0 0.5 ] [ 0 0.164879 0.5 ] [ 0 0.835121 0.5 ] [ 0 0.5 0.5 ] [ 0.5 0.664879 0.5 ] [ 0.5 0.335121 0.5 ] [ 0.757812 0 0.290664 ] [ 0.732831 0.829895 0.705755 ] [ 0.242188 0 0.709336 ] [ 0.267169 0.829895 0.294245 ] [ 0.732831 0.170105 0.705755 ] [ 0.267169 0.170105 0.294245 ] [ 0.257812 0.5 0.290664 ] [ 0.232831 0.329895 0.705755 ] [ 0.742188 0.5 0.709336 ] [ 0.767169 0.329895 0.294245 ] [ 0.232831 0.670105 0.705755 ] [ 0.767169 0.670105 0.294245 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Co" "Co" "Co" "Co" "Co" "Co" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.88765592 "source-unit" "angstrom" } "b" { "source-value" 8.45191543 "source-unit" "angstrom" } "c" { "source-value" 5.05179584 "source-unit" "angstrom" } "beta" { "source-value" 108.87100276 "source-unit" "degree" } }