{ "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" [ [ 0.380431 0.150099 0.597654 ] [ 0.619569 0.650099 0.902346 ] [ 0.380431 0.349901 0.097654 ] [ 0.619569 0.849901 0.402346 ] [ 0 0.5 0.5 ] [ 0 0 0 ] [ 0.189923 0.875223 0.734707 ] [ 0.810077 0.375223 0.765293 ] [ 0.810077 0.124777 0.265293 ] [ 0.189923 0.624777 0.234707 ] ] } "species" { "source-value" [ "Ag" "Ag" "Ag" "Ag" "Hg" "Hg" "S" "S" "S" "S" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.19811187 "source-unit" "angstrom" } "b" { "source-value" 7.98014748 "source-unit" "angstrom" } "c" { "source-value" 6.82305316 "source-unit" "angstrom" } "beta" { "source-value" 110.23906783 "source-unit" "degree" } }