{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-triclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P-1" } "basis-atom-coordinates" { "source-value" [ [ 0.832177 0.365211 0.73747 ] [ 0.167823 0.634789 0.26253 ] [ 0.403037 0.235233 0.96519 ] [ 0.596963 0.764767 0.03481 ] [ 0.843503 0.813046 0.610871 ] [ 0.156497 0.186954 0.389129 ] [ 0.770528 0.497338 0.04705 ] [ 0.267334 0.348882 0.273728 ] [ 0.732666 0.651118 0.726272 ] [ 0.581054 0.774663 0.372886 ] [ 0.082226 0.916805 0.20176 ] [ 0.863855 0.237235 0.428894 ] [ 0.229472 0.502662 0.95295 ] [ 0.917774 0.083195 0.79824 ] [ 0.418946 0.225337 0.627114 ] [ 0.136145 0.762765 0.571106 ] ] } "species" { "source-value" [ "Ni" "Ni" "Bi" "Bi" "As" "As" "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" 5.31633926068 "source-unit" "angstrom" } "b" { "source-value" 6.82920840438 "source-unit" "angstrom" } "c" { "source-value" 6.92414711257 "source-unit" "angstrom" } "alpha" { "source-value" 111.256103148 "source-unit" "degree" } "beta" { "source-value" 107.164162496 "source-unit" "degree" } "gamma" { "source-value" 95.925211439 "source-unit" "degree" } }