{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pm" } "basis-atom-coordinates" { "source-value" [ [ 0.141486 0 0.753638 ] [ 0.85413 0.5 0.504379 ] [ 0.250082 0 0.266493 ] [ 0.350229 0.799955 0.510992 ] [ 0.358103 0.714 0.999938 ] [ 0.637042 0.715027 0.763495 ] [ 0.650271 0.743359 0.248474 ] [ 0.74083 0.5 0.010935 ] [ 0.650271 0.256641 0.248474 ] [ 0.637042 0.284973 0.763495 ] [ 0.350229 0.200045 0.510992 ] [ 0.358103 0.286 0.999938 ] [ 0.856635 0 0.994207 ] [ 0.824469 0 0.500265 ] [ 0.164997 0.5 0.740724 ] [ 0.159327 0.5 0.252047 ] [ 0.840241 0 0.350492 ] [ 0.07693 0 0.565218 ] [ 0.83539 0 0.843703 ] [ 0.115403 0 0.042405 ] [ 0.698865 0.788855 0.548459 ] [ 0.71509 0.803026 0.049857 ] [ 0.288282 0.710756 0.793943 ] [ 0.305022 0.699135 0.302166 ] [ 0.143383 0.5 0.101921 ] [ 0.911364 0.5 0.313854 ] [ 0.171124 0.5 0.590485 ] [ 0.908398 0.5 0.791995 ] [ 0.305022 0.300865 0.302166 ] [ 0.288282 0.289244 0.793943 ] [ 0.698865 0.211145 0.548459 ] [ 0.71509 0.196974 0.049857 ] ] } "species" { "source-value" [ "Li" "Li" "Cu" "Cu" "Cu" "Cu" "Cu" "Cu" "Cu" "Cu" "Cu" "Cu" "P" "P" "P" "P" "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" 5.66216552 "source-unit" "angstrom" } "b" { "source-value" 6.20527268 "source-unit" "angstrom" } "c" { "source-value" 10.34157432 "source-unit" "angstrom" } "beta" { "source-value" 90.75406297 "source-unit" "degree" } }