{ "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/m" } "basis-atom-coordinates" { "source-value" [ [ 0.666667 0.333333 0.75 ] [ 0.333333 0.666667 0.25 ] [ 0.61088 0.697828 0.75 ] [ 0.913053 0.61088 0.25 ] [ 0.38912 0.302172 0.25 ] [ 0.086947 0.38912 0.75 ] [ 0.302172 0.913053 0.75 ] [ 0.697828 0.086947 0.25 ] ] } "species" { "source-value" [ "La" "La" "Br" "Br" "Br" "Br" "Br" "Br" ] } "a" { "source-value" 8.12705955049 "source-unit" "angstrom" } "c" { "source-value" 4.51221682 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 4.4839131875 "source-unit" "eV" } }