{ "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/m" } "basis-atom-coordinates" { "source-value" [ [ 0.70989 0.92996 0.75 ] [ 0.77993 0.70989 0.25 ] [ 0.92996 0.22007 0.25 ] [ 0.07004 0.77993 0.75 ] [ 0.22007 0.29011 0.75 ] [ 0.29011 0.07004 0.25 ] [ 0.333333 0.666667 0.478242 ] [ 0.666667 0.333333 0.978242 ] [ 0.666667 0.333333 0.521758 ] [ 0.333333 0.666667 0.021758 ] [ 0.425591 0.071664 0.395397 ] [ 0.353927 0.425591 0.895397 ] [ 0.071664 0.646073 0.895397 ] [ 0.928336 0.353927 0.395397 ] [ 0.646073 0.574409 0.395397 ] [ 0.574409 0.928336 0.895397 ] [ 0.574409 0.928336 0.604603 ] [ 0.646073 0.574409 0.104603 ] [ 0.928336 0.353927 0.104603 ] [ 0.071664 0.646073 0.604603 ] [ 0.20433 0.267201 0.25 ] [ 0.937129 0.20433 0.75 ] [ 0.267201 0.062871 0.75 ] [ 0.732799 0.937129 0.25 ] [ 0.062871 0.79567 0.25 ] [ 0.79567 0.732799 0.75 ] [ 0.425591 0.071664 0.104603 ] [ 0.353927 0.425591 0.604603 ] ] } "species" { "source-value" [ "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Bi" "Bi" "Bi" "Bi" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" ] } "a" { "source-value" 7.06166952909 "source-unit" "angstrom" } "c" { "source-value" 10.15684749 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 6.256364925714286 "source-unit" "eV" } }