{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-potential-energy-cubic-crystal" "instance-id" 1 "space-group" { "source-value" "Pm3" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] [ 0.5 0.5 0 ] [ 0.5 0 0.5 ] [ 0 0.5 0.5 ] [ 0.5 0 0.706145 ] [ 0 0.706145 0.5 ] [ 0 0.293855 0.5 ] [ 0.5 0 0.293855 ] [ 0.293855 0.5 0 ] [ 0.706145 0.5 0 ] ] } "species" { "source-value" [ "Tl" "Cd" "N" "N" "N" "O" "O" "O" "O" "O" "O" ] } "a" { "source-value" 6.01007043 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 4.716428140909091 "source-unit" "eV" } }