{ "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" [ [ 0.863891 0 0.948698 ] [ 0.136109 0 0.051302 ] [ 0.363891 0.5 0.948698 ] [ 0.636109 0.5 0.051302 ] [ 0.943806 0 0.599664 ] [ 0.056194 0 0.400336 ] [ 0.813366 0.5 0.567571 ] [ 0.186634 0.5 0.432429 ] [ 0.906378 0.5 0.352832 ] [ 0.093622 0.5 0.647168 ] [ 0.443806 0.5 0.599664 ] [ 0.556194 0.5 0.400336 ] [ 0.313366 0 0.567571 ] [ 0.686634 0 0.432429 ] [ 0.406378 0 0.352832 ] [ 0.593622 0 0.647168 ] [ 0.013941 0.5 0.20868 ] [ 0.986059 0.5 0.79132 ] [ 0.798018 0 0.295773 ] [ 0.201982 0 0.704227 ] [ 0.513941 0 0.20868 ] [ 0.486059 0 0.79132 ] [ 0.298018 0.5 0.295773 ] [ 0.701982 0.5 0.704227 ] ] } "species" { "source-value" [ "K" "K" "K" "K" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Se" "Se" "Se" "Se" "Se" "Se" "Se" "Se" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 16.75717138 "source-unit" "angstrom" } "b" { "source-value" 4.43077935 "source-unit" "angstrom" } "c" { "source-value" 8.97282495 "source-unit" "angstrom" } "beta" { "source-value" 115.4586936 "source-unit" "degree" } }