{ "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" [ [ 0.5 0 0.5 ] [ 0.5 0.5 0 ] [ 0 0.5 0.5 ] [ 0 0 0 ] [ 0.146396 0.688146 0.802651 ] [ 0.146396 0.811854 0.302651 ] [ 0.325333 0.330236 0.632569 ] [ 0.674667 0.830236 0.867431 ] [ 0.325333 0.169764 0.132569 ] [ 0.674667 0.669764 0.367431 ] [ 0.853604 0.188146 0.697349 ] [ 0.853604 0.311854 0.197349 ] ] } "species" { "source-value" [ "Li" "Li" "Cu" "Cu" "F" "F" "F" "F" "F" "F" "F" "F" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.6273626 "source-unit" "angstrom" } "b" { "source-value" 4.99185865 "source-unit" "angstrom" } "c" { "source-value" 5.86099968 "source-unit" "angstrom" } "beta" { "source-value" 119.35637025 "source-unit" "degree" } }