{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/m" } "basis-atom-coordinates" { "source-value" [ [ 0.716894 0.25 0.356709 ] [ 0.283106 0.75 0.643291 ] [ 0.116487 0.25 0.80436 ] [ 0.883513 0.75 0.19564 ] [ 0.761366 0.75 0.549667 ] [ 0.238634 0.25 0.450333 ] [ 0.478186 0.75 0.194227 ] [ 0.521814 0.25 0.805773 ] ] } "species" { "source-value" [ "Hf" "Hf" "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" 5.14921004 "source-unit" "angstrom" } "b" { "source-value" 3.61156672 "source-unit" "angstrom" } "c" { "source-value" 9.70602806 "source-unit" "angstrom" } "beta" { "source-value" 96.98825289 "source-unit" "degree" } }