{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "C2" } "basis-atom-coordinates" { "source-value" [ [ 0 0.007424 0 ] [ 0.5 0.507424 0 ] [ 0.757917 0.501009 0.225895 ] [ 0.242083 0.501009 0.774105 ] [ 0.257917 0.001009 0.225895 ] [ 0.742083 0.001009 0.774105 ] [ 0.124868 0.010214 0.326634 ] [ 0.875132 0.010214 0.673366 ] [ 0.624868 0.510214 0.326634 ] [ 0.375132 0.510214 0.673366 ] [ 0.853943 0.495594 0.158529 ] [ 0.146057 0.495594 0.841471 ] [ 0.353943 0.995594 0.158529 ] [ 0.646057 0.995594 0.841471 ] ] } "species" { "source-value" [ "Hg" "Hg" "C" "C" "C" "C" "S" "S" "S" "S" "N" "N" "N" "N" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 11.0467932353 "source-unit" "angstrom" } "b" { "source-value" 4.09004124089 "source-unit" "angstrom" } "c" { "source-value" 6.55884893835 "source-unit" "angstrom" } "beta" { "source-value" 94.2588033292 "source-unit" "degree" } }