{ "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" [ [ 0.818288 0.867513 0.33445 ] [ 0.681712 0.367513 0.66555 ] [ 0.181712 0.132487 0.66555 ] [ 0.318288 0.632487 0.33445 ] [ 0.695031 0.9275 0.798654 ] [ 0.195031 0.5725 0.798654 ] [ 0.304969 0.0725 0.201346 ] [ 0.804969 0.4275 0.201346 ] [ 0.013524 0.753098 0.089594 ] [ 0.306345 0.862726 0.566713 ] [ 0.486476 0.253098 0.910406 ] [ 0.986476 0.246902 0.910406 ] [ 0.693655 0.137274 0.433287 ] [ 0.193655 0.362726 0.433287 ] [ 0.806345 0.637274 0.566713 ] [ 0.513524 0.746902 0.089594 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Ce" "Ce" "Ce" "Ce" "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" 5.81744551 "source-unit" "angstrom" } "b" { "source-value" 6.07216304 "source-unit" "angstrom" } "c" { "source-value" 5.8896946 "source-unit" "angstrom" } "beta" { "source-value" 104.06199136 "source-unit" "degree" } }