{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-potential-energy-hexagonal-crystal" "instance-id" 1 "space-group" { "source-value" "P-6c2" } "basis-atom-coordinates" { "source-value" [ [ 0.666667 0.333333 0 ] [ 0.666667 0.333333 0.5 ] [ 0.333333 0.666667 0 ] [ 0.333333 0.666667 0.5 ] [ 0.076683 0.288654 0.25 ] [ 0.211972 0.923317 0.25 ] [ 0.711346 0.788028 0.25 ] [ 0.711346 0.923317 0.75 ] [ 0.211972 0.288654 0.75 ] [ 0.076683 0.788028 0.75 ] [ 0.264521 0.194544 0.25 ] [ 0.930023 0.735479 0.25 ] [ 0.805456 0.069977 0.25 ] [ 0.805456 0.735479 0.75 ] [ 0.930023 0.194544 0.75 ] [ 0.264521 0.069977 0.75 ] [ 0.102967 0.439318 0.110243 ] [ 0.336351 0.897033 0.389757 ] [ 0.560682 0.663649 0.389757 ] [ 0.560682 0.663649 0.110243 ] [ 0.336351 0.897033 0.110243 ] [ 0.560682 0.897033 0.889757 ] [ 0.336351 0.439318 0.889757 ] [ 0.102967 0.663649 0.889757 ] [ 0.336351 0.439318 0.610243 ] [ 0.102967 0.663649 0.610243 ] [ 0.102967 0.439318 0.389757 ] [ 0.560682 0.897033 0.610243 ] ] } "species" { "source-value" [ "Rb" "Rb" "Ta" "Ta" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" ] } "a" { "source-value" 7.160046189 "source-unit" "angstrom" } "c" { "source-value" 10.27798071 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 7.133033568928572 "source-unit" "eV" } }