{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2/c" } "basis-atom-coordinates" { "source-value" [ [ 0.75 0.917791 0 ] [ 0.25 0.082209 0 ] [ 0.75 0.561349 0 ] [ 0.25 0.438651 0 ] [ 0.792661 0.244356 0.155627 ] [ 0.207339 0.755644 0.844373 ] [ 0.292661 0.755644 0.155627 ] [ 0.707339 0.244356 0.844373 ] [ 0.984114 0.074279 0.20418 ] [ 0.52082 0.769048 0.781355 ] [ 0.47918 0.230952 0.218645 ] [ 0.52406 0.393062 0.736991 ] [ 0.015886 0.925721 0.79582 ] [ 0.02082 0.230952 0.781355 ] [ 0.47594 0.606938 0.263009 ] [ 0.484114 0.925721 0.20418 ] [ 0.515886 0.074279 0.79582 ] [ 0.97594 0.393062 0.263009 ] [ 0.02406 0.606938 0.736991 ] [ 0.97918 0.769048 0.218645 ] ] } "species" { "source-value" [ "Cr" "Cr" "Ag" "Ag" "P" "P" "P" "P" "S" "S" "S" "S" "S" "S" "S" "S" "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" 5.96965300339 "source-unit" "angstrom" } "b" { "source-value" 10.67979517 "source-unit" "angstrom" } "c" { "source-value" 7.36758122573 "source-unit" "angstrom" } "beta" { "source-value" 104.568213604 "source-unit" "degree" } }