{ "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 0.016547 0 ] [ 0.5 0.516547 0 ] [ 0.282533 0.844663 0.569049 ] [ 0.717467 0.844663 0.430951 ] [ 0.782533 0.344663 0.569049 ] [ 0.217467 0.344663 0.430951 ] [ 0.303419 0.9669 0.763485 ] [ 0.696581 0.9669 0.236515 ] [ 0.803419 0.4669 0.763485 ] [ 0.196581 0.4669 0.236515 ] ] } "species" { "source-value" [ "Zn" "Zn" "H" "H" "H" "H" "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" 5.52833159752 "source-unit" "angstrom" } "b" { "source-value" 3.32586273333 "source-unit" "angstrom" } "c" { "source-value" 4.58002882118 "source-unit" "angstrom" } "beta" { "source-value" 91.6262919283 "source-unit" "degree" } }