{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-potential-energy-hexagonal-crystal" "instance-id" 1 "space-group" { "source-value" "P6_3mc" } "basis-atom-coordinates" { "source-value" [ [ 0.169366 0.830634 0.552594 ] [ 0.169366 0.338732 0.552594 ] [ 0.661268 0.830634 0.552594 ] [ 0.338732 0.169366 0.052594 ] [ 0.830634 0.661268 0.052594 ] [ 0.830634 0.169366 0.052594 ] [ 0.167215 0.832785 0.28554 ] [ 0.167215 0.334429 0.28554 ] [ 0.665571 0.832785 0.28554 ] [ 0.334429 0.167215 0.78554 ] [ 0.832785 0.665571 0.78554 ] [ 0.832785 0.167215 0.78554 ] [ 0.333333 0.666667 0.007721 ] [ 0.666667 0.333333 0.507721 ] [ 0 0 0.678035 ] [ 0.153657 0.846343 0.898758 ] [ 0.032118 0.516059 0.167214 ] [ 0.153657 0.307314 0.898758 ] [ 0 0 0.178035 ] [ 0.333333 0.666667 0.396516 ] [ 0.483941 0.967882 0.167214 ] [ 0.483941 0.516059 0.167214 ] [ 0.307314 0.153657 0.398758 ] [ 0.692686 0.846343 0.898758 ] [ 0.516059 0.483941 0.667214 ] [ 0.666667 0.333333 0.896516 ] [ 0.516059 0.032118 0.667214 ] [ 0.846343 0.692686 0.398758 ] [ 0.967882 0.483941 0.667214 ] [ 0.846343 0.153657 0.398758 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Co" "Co" "Co" "Co" "Co" "Co" "Ni" "Ni" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" ] } "a" { "source-value" 5.64222461 "source-unit" "angstrom" } "c" { "source-value" 9.24581547 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 5.449387505000001 "source-unit" "eV" } }