{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_12_12_1" } "basis-atom-coordinates" { "source-value" [ [ 0.321618 0.564592 0.666761 ] [ 0.821618 0.935408 0.333239 ] [ 0.678382 0.064592 0.833239 ] [ 0.178382 0.435408 0.166761 ] [ 0.544745 0.128074 0.558728 ] [ 0.044745 0.371926 0.441272 ] [ 0.455255 0.628074 0.941272 ] [ 0.955255 0.871926 0.058728 ] [ 0.880845 0.299224 0.60592 ] [ 0.380845 0.200776 0.39408 ] [ 0.119155 0.799224 0.89408 ] [ 0.619155 0.700776 0.10592 ] [ 0.145005 0.128843 0.663026 ] [ 0.645005 0.371157 0.336974 ] [ 0.854995 0.628843 0.836974 ] [ 0.354995 0.871157 0.163026 ] [ 0.80521 0.128831 0.095865 ] [ 0.30521 0.371169 0.904135 ] [ 0.19479 0.628831 0.404135 ] [ 0.69479 0.871169 0.595865 ] [ 0.417025 0.079571 0.069795 ] [ 0.917025 0.420429 0.930205 ] [ 0.582975 0.579571 0.430205 ] [ 0.082975 0.920429 0.569795 ] ] } "species" { "source-value" [ "Cs" "Cs" "Cs" "Cs" "Ag" "Ag" "Ag" "Ag" "Se" "Se" "Se" "Se" "Se" "Se" "Se" "Se" "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" 5.92524672 "source-unit" "angstrom" } "b" { "source-value" 9.49198376 "source-unit" "angstrom" } "c" { "source-value" 14.46585924 "source-unit" "angstrom" } }