{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-potential-energy-hexagonal-crystal" "instance-id" 1 "space-group" { "source-value" "P-62m" } "basis-atom-coordinates" { "source-value" [ [ 0 0.583425 0 ] [ 0.583425 0 0 ] [ 0.416575 0.416575 0 ] [ 0.234439 0 0.5 ] [ 0.765561 0.765561 0.5 ] [ 0 0.234439 0.5 ] [ 0.666667 0.333333 0.5 ] [ 0 0 0 ] [ 0.333333 0.666667 0.5 ] ] } "species" { "source-value" [ "Y" "Y" "Y" "Al" "Al" "Al" "Ni" "Ni" "Ni" ] } "a" { "source-value" 6.95784715731 "source-unit" "angstrom" } "c" { "source-value" 3.91917381 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 5.9297394 "source-unit" "eV" } }