{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-potential-energy-hexagonal-crystal" "instance-id" 1 "space-group" { "source-value" "P6_3/mmc" } "basis-atom-coordinates" { "source-value" [ [ 0.666667 0.333333 0.25 ] [ 0 0 0.75 ] [ 0.333333 0.666667 0.75 ] [ 0 0 0.25 ] [ 0.333333 0.666667 0.580158 ] [ 0.666667 0.333333 0.419842 ] [ 0.867513 0.735026 0.75 ] [ 0.666667 0.333333 0.080158 ] [ 0.264974 0.132487 0.75 ] [ 0.132487 0.264974 0.25 ] [ 0.132487 0.867513 0.25 ] [ 0.867513 0.132487 0.75 ] [ 0.333333 0.666667 0.919842 ] [ 0.735026 0.867513 0.25 ] ] } "species" { "source-value" [ "N" "N" "N" "N" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" ] } "short-name" { "source-value" [ "hcp" ] } "a" { "source-value" 5.5366893127 "source-unit" "angstrom" } "c" { "source-value" 6.71897819 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 6.025037008571429 "source-unit" "eV" } }