{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pc" } "basis-atom-coordinates" { "source-value" [ [ 0.132336 0.330731 0.783039 ] [ 0.643839 0.826212 0.624609 ] [ 0.132336 0.669269 0.283039 ] [ 0.643839 0.173788 0.124609 ] [ 0.751037 0.683669 0.006233 ] [ 0.257715 0.792343 0.653117 ] [ 0.751037 0.316331 0.506233 ] [ 0.257715 0.207657 0.153117 ] [ 0.036201 0.842182 0.927961 ] [ 0.503657 0.322333 0.743707 ] [ 0.036201 0.157818 0.427961 ] [ 0.503657 0.677667 0.243707 ] [ 0.111925 0.24229 0.985062 ] [ 0.698755 0.390355 0.97628 ] [ 0.226774 0.646835 0.800669 ] [ 0.254632 0.103277 0.672966 ] [ 0.761439 0.809004 0.84048 ] [ 0.430428 0.69495 0.635558 ] [ 0.111925 0.75771 0.485062 ] [ 0.617787 0.176943 0.573483 ] [ 0.934676 0.267953 0.623037 ] [ 0.698755 0.609645 0.47628 ] [ 0.226774 0.353165 0.300669 ] [ 0.254632 0.896723 0.172966 ] [ 0.761439 0.190996 0.34048 ] [ 0.430428 0.30505 0.135558 ] [ 0.617787 0.823057 0.073483 ] [ 0.934676 0.732047 0.123037 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Si" "Si" "Si" "Si" "Bi" "Bi" "Bi" "Bi" "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" 8.85239863 "source-unit" "angstrom" } "b" { "source-value" 5.37368413 "source-unit" "angstrom" } "c" { "source-value" 8.93433121 "source-unit" "angstrom" } "beta" { "source-value" 107.64590875 "source-unit" "degree" } }