{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "C2/m" } "basis-atom-coordinates" { "source-value" [ [ 0.255176 0.5 0.355703 ] [ 0.961282 0.5 0.278315 ] [ 0.038718 0.5 0.721685 ] [ 0.744824 0.5 0.644297 ] [ 0.755176 0 0.355703 ] [ 0.461282 0 0.278315 ] [ 0.538718 0 0.721685 ] [ 0.244824 0 0.644297 ] [ 0 0 0 ] [ 0.5 0.5 0 ] [ 0.385501 0.5 0.298723 ] [ 0.848137 0 0.794126 ] [ 0.146208 0.5 0.463058 ] [ 0.944919 0.5 0.068434 ] [ 0.055081 0.5 0.931566 ] [ 0.853792 0.5 0.536942 ] [ 0.151863 0 0.205874 ] [ 0.614499 0.5 0.701277 ] [ 0.885501 0 0.298723 ] [ 0.348137 0.5 0.794126 ] [ 0.646208 0 0.463058 ] [ 0.444919 0 0.068434 ] [ 0.555081 0 0.931566 ] [ 0.353792 0 0.536942 ] [ 0.651863 0.5 0.205874 ] [ 0.114499 0 0.701277 ] ] } "species" { "source-value" [ "Ga" "Ga" "Ga" "Ga" "Ga" "Ga" "Ga" "Ga" "Si" "Si" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "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" 12.44950664 "source-unit" "angstrom" } "b" { "source-value" 2.98249134 "source-unit" "angstrom" } "c" { "source-value" 9.40821086 "source-unit" "angstrom" } "beta" { "source-value" 126.11084064 "source-unit" "degree" } }