{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/c" } "basis-atom-coordinates" { "source-value" [ [ 0.914488 0.533438 0.664778 ] [ 0.085512 0.033438 0.835222 ] [ 0.914488 0.966562 0.164778 ] [ 0.085512 0.466562 0.335222 ] [ 0.404217 0.686245 0.159661 ] [ 0.595783 0.186245 0.340339 ] [ 0.404217 0.813755 0.659661 ] [ 0.595783 0.313755 0.840339 ] [ 0.727632 0.776233 0.717234 ] [ 0.436305 0.621807 0.342988 ] [ 0.211316 0.849374 0.094591 ] [ 0.755881 0.055195 0.502387 ] [ 0.244119 0.555195 0.997613 ] [ 0.788684 0.349374 0.405409 ] [ 0.563695 0.121807 0.157012 ] [ 0.727632 0.723767 0.217234 ] [ 0.272368 0.276233 0.782766 ] [ 0.436305 0.878193 0.842988 ] [ 0.211316 0.650626 0.594591 ] [ 0.755881 0.444805 0.002387 ] [ 0.244119 0.944805 0.497613 ] [ 0.788684 0.150626 0.905409 ] [ 0.563695 0.378193 0.657012 ] [ 0.272368 0.223767 0.282766 ] ] } "species" { "source-value" [ "Ag" "Ag" "Ag" "Ag" "Br" "Br" "Br" "Br" "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" 5.84442236 "source-unit" "angstrom" } "b" { "source-value" 8.66993505 "source-unit" "angstrom" } "c" { "source-value" 9.2082577 "source-unit" "angstrom" } "beta" { "source-value" 126.44489565 "source-unit" "degree" } }