{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-potential-energy-hexagonal-crystal" "instance-id" 1 "space-group" { "source-value" "P-3" } "basis-atom-coordinates" { "source-value" [ [ 0.333333 0.666667 0.601683 ] [ 0.666667 0.333333 0.398317 ] [ 0 0 0 ] [ 0.333333 0.666667 0.066012 ] [ 0.666667 0.333333 0.933988 ] [ 0.229138 0.890728 0.221794 ] [ 0.890728 0.66159 0.778206 ] [ 0.770862 0.109272 0.778206 ] [ 0.33841 0.229138 0.778206 ] [ 0.66159 0.770862 0.221794 ] [ 0.109272 0.33841 0.221794 ] ] } "species" { "source-value" [ "K" "K" "Sn" "As" "As" "S" "S" "S" "S" "S" "S" ] } "a" { "source-value" 6.78498595893 "source-unit" "angstrom" } "c" { "source-value" 7.3990152 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 4.266290290909091 "source-unit" "eV" } }