{ "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 0.411258 ] [ 0.333333 0.666667 0.911258 ] [ 0.666667 0.333333 0.088742 ] [ 0.333333 0.666667 0.588742 ] [ 0 0 0.25 ] [ 0 0 0.75 ] [ 0 0 0.674981 ] [ 0 0 0.174981 ] [ 0 0 0.825019 ] [ 0 0 0.325019 ] [ 0.666667 0.333333 0.948231 ] [ 0.333333 0.666667 0.051769 ] [ 0.333333 0.666667 0.448231 ] [ 0.666667 0.333333 0.551769 ] ] } "species" { "source-value" [ "Y" "Y" "Y" "Y" "C" "C" "N" "N" "N" "N" "O" "O" "O" "O" ] } "short-name" { "source-value" [ "hcp" ] } "a" { "source-value" 3.74310861651 "source-unit" "angstrom" } "c" { "source-value" 16.47121592 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 9.121267972857144 "source-unit" "eV" } }