{ "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" [ [ 0.676816 0.362039 0.664978 ] [ 0.323184 0.637961 0.335022 ] [ 0.176816 0.137961 0.664978 ] [ 0.823184 0.862039 0.335022 ] [ 0.195275 0.571049 0.797852 ] [ 0.304725 0.071049 0.202148 ] [ 0.804725 0.428951 0.202148 ] [ 0.695275 0.928951 0.797852 ] [ 0.297693 0.864979 0.571682 ] [ 0.797693 0.635021 0.571682 ] [ 0.202307 0.364979 0.428318 ] [ 0.702307 0.135021 0.428318 ] [ 0.516843 0.738757 0.083757 ] [ 0.983157 0.238757 0.916243 ] [ 0.483157 0.261243 0.916243 ] [ 0.016843 0.761243 0.083757 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Sm" "Sm" "Sm" "Sm" "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" 5.72976216 "source-unit" "angstrom" } "b" { "source-value" 6.04498451 "source-unit" "angstrom" } "c" { "source-value" 5.74008729 "source-unit" "angstrom" } "beta" { "source-value" 102.79092733 "source-unit" "degree" } }