{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pbnm" } "basis-atom-coordinates" { "source-value" [ [ 0.49229 0.466534 0.75 ] [ 0.99229 0.033466 0.25 ] [ 0.00771 0.966534 0.75 ] [ 0.50771 0.533466 0.25 ] [ 0 0.5 0.5 ] [ 0.5 0 0.5 ] [ 0.5 0 0 ] [ 0 0.5 0 ] [ 0.71621 0.284774 0.458814 ] [ 0.21621 0.215226 0.541186 ] [ 0.78379 0.784774 0.041186 ] [ 0.28379 0.715226 0.958814 ] [ 0.28379 0.715226 0.541186 ] [ 0.78379 0.784774 0.458814 ] [ 0.21621 0.215226 0.958814 ] [ 0.71621 0.284774 0.041186 ] [ 0.076628 0.484556 0.25 ] [ 0.576628 0.015444 0.75 ] [ 0.423372 0.984556 0.25 ] [ 0.923372 0.515444 0.75 ] ] } "species" { "source-value" [ "La" "La" "La" "La" "Ga" "Ga" "Ga" "Ga" "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" 5.55920281 "source-unit" "angstrom" } "b" { "source-value" 5.58868787 "source-unit" "angstrom" } "c" { "source-value" 7.87857479 "source-unit" "angstrom" } }