{ "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/mmc" } "basis-atom-coordinates" { "source-value" [ [ 0.666667 0.333333 0.828155 ] [ 0.666667 0.333333 0.980699 ] [ 0.333333 0.666667 0.480699 ] [ 0.333333 0.666667 0.019301 ] [ 0.333333 0.666667 0.171845 ] [ 0.666667 0.333333 0.519301 ] [ 0.666667 0.333333 0.671845 ] [ 0.333333 0.666667 0.328155 ] [ 0.162854 0.325707 0.89458 ] [ 0.162854 0.837146 0.60542 ] [ 0.837146 0.162854 0.39458 ] [ 0.334791 0.167396 0.25 ] [ 0.325707 0.162854 0.39458 ] [ 0.837146 0.674293 0.10542 ] [ 0.837146 0.674293 0.39458 ] [ 0.832604 0.665209 0.25 ] [ 0.674293 0.837146 0.60542 ] [ 0.665209 0.832604 0.75 ] [ 0.837146 0.162854 0.10542 ] [ 0.674293 0.837146 0.89458 ] [ 0 0 0 ] [ 0.167396 0.334791 0.75 ] [ 0.167396 0.832604 0.75 ] [ 0.832604 0.167396 0.25 ] [ 0.325707 0.162854 0.10542 ] [ 0 0 0.5 ] [ 0.162854 0.837146 0.89458 ] [ 0.162854 0.325707 0.60542 ] [ 0.333333 0.666667 0.825323 ] [ 0.333333 0.666667 0.674677 ] [ 0.666667 0.333333 0.325323 ] [ 0 0 0.823122 ] [ 0.666667 0.333333 0.174677 ] [ 0 0 0.676878 ] [ 0 0 0.323122 ] [ 0 0 0.176878 ] ] } "species" { "source-value" [ "Ce" "Ce" "Ce" "Ce" "Ce" "Ce" "Ce" "Ce" "Co" "Co" "Co" "Co" "Co" "Co" "Co" "Co" "Co" "Co" "Co" "Co" "Co" "Co" "Co" "Co" "Co" "Co" "Co" "Co" "B" "B" "B" "B" "B" "B" "B" "B" ] } "short-name" { "source-value" [ "hcp" ] } "a" { "source-value" 5.09179209151 "source-unit" "angstrom" } "c" { "source-value" 19.83956803 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 7.191392796944445 "source-unit" "eV" } }