{ "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" [ [ 0.25 0.619986 0.370525 ] [ 0.75 0.380014 0.629475 ] [ 0.25 0.119986 0.129475 ] [ 0.75 0.880014 0.870525 ] [ 0.25 0.903699 0.604452 ] [ 0.75 0.096301 0.395548 ] [ 0.25 0.403699 0.895548 ] [ 0.75 0.596301 0.104452 ] [ 0.75 0.359801 0.843625 ] [ 0.25 0.640199 0.156375 ] [ 0.75 0.859801 0.656375 ] [ 0.25 0.140199 0.343625 ] [ 0.75 0.266467 0.988535 ] [ 0.25 0.733533 0.011465 ] [ 0.75 0.766467 0.511465 ] [ 0.25 0.233533 0.488535 ] ] } "species" { "source-value" [ "U" "U" "U" "U" "W" "W" "W" "W" "C" "C" "C" "C" "C" "C" "C" "C" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.93042926 "source-unit" "angstrom" } "b" { "source-value" 5.2812722 "source-unit" "angstrom" } "c" { "source-value" 10.65780375 "source-unit" "angstrom" } }