{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-potential-energy-hexagonal-crystal" "instance-id" 1 "space-group" { "source-value" "P3_121" } "basis-atom-coordinates" { "source-value" [ [ 0.539263 0.539263 0 ] [ 0 0.460737 0.666667 ] [ 0.460737 0 0.333333 ] [ 0.537686 0.537686 0.5 ] [ 0 0.462314 0.166667 ] [ 0.462314 0 0.833333 ] [ 0.266576 0.412468 0.125736 ] [ 0.587532 0.854108 0.459069 ] [ 0.145892 0.733424 0.792402 ] [ 0.854108 0.587532 0.540931 ] [ 0.733424 0.145892 0.207598 ] [ 0.412468 0.266576 0.874264 ] [ 0.40804 0.310598 0.394203 ] [ 0.689402 0.097442 0.727536 ] [ 0.902558 0.59196 0.060869 ] [ 0.097442 0.689402 0.272464 ] [ 0.59196 0.902558 0.939131 ] [ 0.310598 0.40804 0.605797 ] ] } "species" { "source-value" [ "Ga" "Ga" "Ga" "P" "P" "P" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" ] } "a" { "source-value" 5.00913586183 "source-unit" "angstrom" } "c" { "source-value" 11.24742987 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 6.82690006 "source-unit" "eV" } }