{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2/m" } "basis-atom-coordinates" { "source-value" [ [ 0.762687 0 0.301791 ] [ 0.237313 0 0.698209 ] [ 0 0 0 ] [ 0.277296 0.5 0.313509 ] [ 0.5 0.5 0 ] [ 0.722704 0.5 0.686491 ] [ 0.890787 0 0.623653 ] [ 0.357649 0.5 0.630142 ] [ 0.201086 0.5 0.109891 ] [ 0.296928 0 0.889778 ] [ 0.703072 0 0.110222 ] [ 0.798914 0.5 0.890109 ] [ 0.642351 0.5 0.369858 ] [ 0.109213 0 0.376347 ] ] } "species" { "source-value" [ "Zn" "Zn" "In" "In" "In" "In" "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" 6.74207325 "source-unit" "angstrom" } "b" { "source-value" 3.96537442 "source-unit" "angstrom" } "c" { "source-value" 12.78693296 "source-unit" "angstrom" } "beta" { "source-value" 99.42001143 "source-unit" "degree" } }