{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-cubic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_13" } "basis-atom-coordinates" { "source-value" [ [ 0.030755 0.969245 0.469245 ] [ 0.179281 0.679281 0.820719 ] [ 0.204077 0.295923 0.704077 ] [ 0.295923 0.704077 0.204077 ] [ 0.320719 0.320719 0.320719 ] [ 0.469245 0.030755 0.969245 ] [ 0.530755 0.530755 0.530755 ] [ 0.679281 0.820719 0.179281 ] [ 0.704077 0.204077 0.295923 ] [ 0.795923 0.795923 0.795923 ] [ 0.820719 0.179281 0.679281 ] [ 0.969245 0.469245 0.030755 ] [ 0.075515 0.075515 0.075515 ] [ 0.424485 0.924485 0.575515 ] [ 0.575515 0.424485 0.924485 ] [ 0.924485 0.575515 0.424485 ] [ 0.994152 0.748608 0.122996 ] [ 0.122996 0.994152 0.748608 ] [ 0.251392 0.622996 0.505848 ] [ 0.248608 0.377004 0.005848 ] [ 0.377004 0.005848 0.248608 ] [ 0.505848 0.251392 0.622996 ] [ 0.494152 0.751392 0.877004 ] [ 0.622996 0.505848 0.251392 ] [ 0.751392 0.877004 0.494152 ] [ 0.748608 0.122996 0.994152 ] [ 0.877004 0.494152 0.751392 ] [ 0.005848 0.248608 0.377004 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Bi" "Bi" "Bi" "Bi" "S" "S" "S" "S" "S" "S" "S" "S" "S" "S" "S" "S" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 8.13921321 "source-unit" "angstrom" } }