{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-potential-energy-cubic-crystal" "instance-id" 1 "space-group" { "source-value" "I-43d" } "basis-atom-coordinates" { "source-value" [ [ 0.570565 0.429435 0.929435 ] [ 0.820565 0.820565 0.820565 ] [ 0.429435 0.929435 0.570565 ] [ 0.929435 0.570565 0.429435 ] [ 0.179435 0.679435 0.820565 ] [ 0.179435 0.320565 0.679435 ] [ 0.820565 0.179435 0.679435 ] [ 0.070565 0.070565 0.070565 ] [ 0.070565 0.929435 0.429435 ] [ 0.320565 0.320565 0.320565 ] [ 0.929435 0.429435 0.070565 ] [ 0.429435 0.070565 0.929435 ] [ 0.679435 0.179435 0.320565 ] [ 0.679435 0.820565 0.179435 ] [ 0.320565 0.679435 0.179435 ] [ 0.570565 0.570565 0.570565 ] [ 0.125 0 0.75 ] [ 0.5 0.75 0.875 ] [ 0 0.75 0.125 ] [ 0.75 0.125 0 ] [ 0.75 0.875 0.5 ] [ 0.875 0.5 0.75 ] [ 0.625 0.5 0.25 ] [ 0 0.25 0.375 ] [ 0.5 0.25 0.625 ] [ 0.25 0.625 0.5 ] [ 0.25 0.375 0 ] [ 0.375 0 0.25 ] ] } "species" { "source-value" [ "Nd" "Nd" "Nd" "Nd" "Nd" "Nd" "Nd" "Nd" "Nd" "Nd" "Nd" "Nd" "Nd" "Nd" "Nd" "Nd" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" ] } "a" { "source-value" 9.52060064925 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 5.554493553571429 "source-unit" "eV" } }