{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-potential-energy-hexagonal-crystal" "instance-id" 1 "space-group" { "source-value" "P-6" } "basis-atom-coordinates" { "source-value" [ [ 0.995513 0.292726 0.5 ] [ 0.707274 0.702787 0.5 ] [ 0.297213 0.004487 0.5 ] [ 0.364397 0.366313 0 ] [ 0.001916 0.635603 0 ] [ 0.633687 0.998084 0 ] [ 0.333333 0.666667 0.5 ] [ 0 0 0 ] [ 0.666667 0.333333 0.5 ] [ 0.260771 0.484039 0.5 ] [ 0.515961 0.776732 0.5 ] [ 0.223268 0.739229 0.5 ] [ 0.934476 0.115766 0 ] [ 0.569576 0.149855 0.5 ] [ 0.18129 0.065524 0 ] [ 0.850145 0.419721 0.5 ] [ 0.580279 0.430424 0.5 ] [ 0.884234 0.81871 0 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Cu" "Cu" "Cu" "C" "C" "C" "O" "O" "O" "O" "O" "O" "O" "O" "O" ] } "a" { "source-value" 8.19427216 "source-unit" "angstrom" } "c" { "source-value" 3.1587239 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 6.26880042 "source-unit" "eV" } }