{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-potential-energy-cubic-crystal" "instance-id" 1 "space-group" { "source-value" "Im-3m" } "basis-atom-coordinates" { "source-value" [ [ 0.25 0.25 0.75 ] [ 0.75 0.25 0.25 ] [ 0.75 0.25 0.75 ] [ 0.25 0.25 0.25 ] [ 0.75 0.75 0.25 ] [ 0.25 0.75 0.75 ] [ 0.25 0.75 0.25 ] [ 0.75 0.75 0.75 ] [ 0.5 0.5 0.5 ] [ 0 0 0 ] [ 0.5 0.78601 0.5 ] [ 0.5 0.5 0.78601 ] [ 0.78601 0.5 0.5 ] [ 0.71399 0 0 ] [ 0 0.71399 0 ] [ 0 0 0.71399 ] [ 0 0.28601 0 ] [ 0 0 0.28601 ] [ 0.28601 0 0 ] [ 0.21399 0.5 0.5 ] [ 0.5 0.21399 0.5 ] [ 0.5 0.5 0.21399 ] ] } "species" { "source-value" [ "K" "K" "K" "K" "K" "K" "K" "K" "Mn" "Mn" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" ] } "short-name" { "source-value" [ "bcc" ] } "a" { "source-value" 8.98947540009 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 3.9412945963636363 "source-unit" "eV" } }