{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmnb" } "basis-atom-coordinates" { "source-value" [ [ 0.75 0.640297 0.567186 ] [ 0.25 0.859703 0.067186 ] [ 0.75 0.140298 0.932814 ] [ 0.25 0.359702 0.432814 ] [ 0.25 0.467875 0.829893 ] [ 0.25 0.967875 0.670107 ] [ 0.75 0.032125 0.329893 ] [ 0.75 0.532125 0.170107 ] [ 0.25 0.733829 0.380613 ] [ 0.25 0.233829 0.119387 ] [ 0.75 0.266171 0.619387 ] [ 0.75 0.766171 0.880613 ] ] } "species" { "source-value" [ "Co" "Co" "Co" "Co" "Mo" "Mo" "Mo" "Mo" "P" "P" "P" "P" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.74476754 "source-unit" "angstrom" } "b" { "source-value" 5.80852231 "source-unit" "angstrom" } "c" { "source-value" 6.7393138 "source-unit" "angstrom" } }