{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cm" } "basis-atom-coordinates" { "source-value" [ [ 0.436226 0 0.463154 ] [ 0.936226 0.5 0.463154 ] [ 0.0214 0 0.109311 ] [ 0.5214 0.5 0.109311 ] [ 0.153671 0 0.386019 ] [ 0.939351 0.232574 0.978258 ] [ 0.939351 0.767426 0.978258 ] [ 0.653671 0.5 0.386019 ] [ 0.439351 0.732574 0.978258 ] [ 0.439351 0.267426 0.978258 ] ] } "species" { "source-value" [ "Cu" "Cu" "C" "C" "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" 7.79478681154 "source-unit" "angstrom" } "b" { "source-value" 4.82562974215 "source-unit" "angstrom" } "c" { "source-value" 3.09388252877 "source-unit" "angstrom" } "beta" { "source-value" 97.9579955444 "source-unit" "degree" } }