{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cmmm" } "basis-atom-coordinates" { "source-value" [ [ 0.75 0.75 0.5 ] [ 0.75 0.25 0.5 ] [ 0.25 0.25 0.5 ] [ 0.25 0.75 0.5 ] [ 0 0 0 ] [ 0.5 0.5 0 ] [ 0.227904 0 0.5 ] [ 0 0.2372 0 ] [ 0.772096 0 0.5 ] [ 0 0.7628 0 ] [ 0.727904 0.5 0.5 ] [ 0.5 0.7372 0 ] [ 0.272096 0.5 0.5 ] [ 0.5 0.2628 0 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Co" "Co" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.28976573626 "source-unit" "angstrom" } "b" { "source-value" 10.2933864922 "source-unit" "angstrom" } "c" { "source-value" 3.62745026 "source-unit" "angstrom" } }