{ "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" [ [ 0.208643 0.225309 0.943857 ] [ 0.291357 0.225309 0.556143 ] [ 0.708643 0.774691 0.443857 ] [ 0.791357 0.774691 0.056143 ] [ 0.75 0.676143 0.25 ] [ 0.5 0 0 ] [ 0 0.5 0 ] [ 0.5 0 0.5 ] [ 0.25 0.323857 0.75 ] [ 0.5 0.5 0.5 ] [ 0 0 0 ] [ 0 0 0.5 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "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" 4.68198054435 "source-unit" "angstrom" } "b" { "source-value" 4.68626551935 "source-unit" "angstrom" } "c" { "source-value" 7.83153659923 "source-unit" "angstrom" } "beta" { "source-value" 99.58455235 "source-unit" "degree" } }