{ "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 0 0.75 ] [ 0.507339 0.014678 0.25 ] [ 0.507339 0.492661 0.25 ] [ 0 0 0.25 ] [ 0.985322 0.492661 0.25 ] [ 0.492661 0.985322 0.75 ] [ 0.492661 0.507339 0.75 ] [ 0.014678 0.507339 0.75 ] [ 0.833316 0.166684 0.499731 ] [ 0.833316 0.666633 0.499731 ] [ 0.333367 0.166684 0.499731 ] [ 0.166684 0.333367 0.500269 ] [ 0.333367 0.166684 0.000269 ] [ 0.833316 0.166684 0.000269 ] [ 0.833316 0.666633 0.000269 ] [ 0.166684 0.333367 0.999731 ] [ 0.666633 0.833316 0.999731 ] [ 0.666633 0.833316 0.500269 ] [ 0.166684 0.833316 0.500269 ] [ 0.166684 0.833316 0.999731 ] [ 0.666667 0.333333 0.529365 ] [ 0.333333 0.666667 0.470635 ] [ 0.666667 0.333333 0.970635 ] [ 0.333333 0.666667 0.029365 ] ] } "species" { "source-value" [ "Tb" "Tb" "Tb" "Tb" "Tb" "Tb" "Tb" "Tb" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Rh" "Rh" "Rh" "Rh" ] } "short-name" { "source-value" [ "hcp" ] } "a" { "source-value" 8.19188758034 "source-unit" "angstrom" } "c" { "source-value" 7.96016616 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 6.41913058875 "source-unit" "eV" } }