{ "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 0.484932 0.800757 ] [ 0.75 0.515068 0.199243 ] [ 0.25 0.984932 0.699243 ] [ 0.75 0.015068 0.300757 ] [ 0.25 0.822472 0.076487 ] [ 0.75 0.177528 0.923513 ] [ 0.25 0.322472 0.423513 ] [ 0.75 0.677528 0.576487 ] [ 0.75 0.778503 0.904643 ] [ 0.25 0.221497 0.095357 ] [ 0.75 0.278503 0.595357 ] [ 0.25 0.721497 0.404643 ] ] } "species" { "source-value" [ "Er" "Er" "Er" "Er" "Ga" "Ga" "Ga" "Ga" "Pd" "Pd" "Pd" "Pd" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.45783546 "source-unit" "angstrom" } "b" { "source-value" 6.87955739 "source-unit" "angstrom" } "c" { "source-value" 7.64293941 "source-unit" "angstrom" } }