{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Ibmm" } "basis-atom-coordinates" { "source-value" [ [ 0.75 0.25 0.75 ] [ 0.25 0.25 0.75 ] [ 0.25 0.75 0.25 ] [ 0.75 0.75 0.25 ] [ 0 0 0.5 ] [ 0.75 0.75 0.75 ] [ 0.25 0.75 0.75 ] [ 0.5 0 0 ] [ 0.5 0.5 0 ] [ 0.25 0.25 0.25 ] [ 0.75 0.25 0.25 ] [ 0 0.5 0.5 ] [ 0 0.97675 0.738787 ] [ 0.221061 0.25 0.483763 ] [ 0.5 0.97675 0.761213 ] [ 0.721061 0.25 0.016237 ] [ 0.278939 0.75 0.983763 ] [ 0.5 0.02325 0.238787 ] [ 0.778939 0.75 0.516237 ] [ 0 0.02325 0.261213 ] [ 0.5 0.47675 0.238787 ] [ 0.721061 0.75 0.983763 ] [ 0 0.47675 0.261213 ] [ 0.221061 0.75 0.516237 ] [ 0.778939 0.25 0.483763 ] [ 0 0.52325 0.738787 ] [ 0.278939 0.25 0.016237 ] [ 0.5 0.52325 0.761213 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Co" "Co" "Co" "Co" "Co" "Co" "Co" "Co" "O" "O" "O" "O" "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" 5.67119476 "source-unit" "angstrom" } "b" { "source-value" 5.73551793 "source-unit" "angstrom" } "c" { "source-value" 7.95674318 "source-unit" "angstrom" } }