{ "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" [ [ 0.423214 0.596247 0.183235 ] [ 0.576786 0.096247 0.316765 ] [ 0.423214 0.903753 0.683235 ] [ 0.576786 0.403753 0.816765 ] [ 0.792916 0.881623 0.054634 ] [ 0.207084 0.381623 0.445366 ] [ 0.792916 0.618377 0.554634 ] [ 0.207084 0.118377 0.945366 ] [ 0.904272 0.328818 0.137587 ] [ 0.095728 0.828818 0.362413 ] [ 0.904272 0.171182 0.637587 ] [ 0.095728 0.671182 0.862413 ] [ 0.774904 0.250993 0.011313 ] [ 0.349955 0.000427 0.111286 ] [ 0.868017 0.462643 0.12653 ] [ 0.941967 0.760487 0.238623 ] [ 0.058033 0.260487 0.261377 ] [ 0.131983 0.962643 0.37347 ] [ 0.650045 0.500427 0.388714 ] [ 0.225096 0.750993 0.488687 ] [ 0.774904 0.249007 0.511313 ] [ 0.349955 0.499573 0.611286 ] [ 0.868017 0.037357 0.62653 ] [ 0.941967 0.739513 0.738623 ] [ 0.058033 0.239513 0.761377 ] [ 0.131983 0.537357 0.87347 ] [ 0.650045 0.999573 0.888714 ] [ 0.225096 0.749007 0.988687 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Co" "Co" "Co" "Co" "C" "C" "C" "C" "O" "O" "O" "O" "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" 2.95617708 "source-unit" "angstrom" } "b" { "source-value" 9.2715536 "source-unit" "angstrom" } "c" { "source-value" 9.52274684 "source-unit" "angstrom" } "beta" { "source-value" 106.69865331 "source-unit" "degree" } }