9
1
mirror of https://github.com/QuantumPackage/qp2.git synced 2024-11-18 11:23:38 +01:00
qp2/ocaml/Excitation.mli

31 lines
770 B
OCaml
Raw Normal View History

2019-01-25 11:39:31 +01:00
module Hole :
sig
type t
val to_mo_class : t -> MO_class.t
val of_mo_class : MO_class.t -> t
val t_of_sexp : Sexplib.Sexp.t -> t
val sexp_of_t : t -> Sexplib.Sexp.t
end
module Particle :
sig
type t
val to_mo_class : t -> MO_class.t
val of_mo_class : MO_class.t -> t
val t_of_sexp : Sexplib.Sexp.t -> t
val sexp_of_t : t -> Sexplib.Sexp.t
end
type t =
| Single of Hole.t * Particle.t
| Double of Hole.t * Particle.t * Hole.t * Particle.t
[@@deriving sexp]
val create_single : hole:MO_class.t -> particle:MO_class.t -> t
val double_of_singles : t -> t -> t
val create_double : hole1:MO_class.t -> particle1:MO_class.t ->
hole2:MO_class.t -> particle2:MO_class.t -> t
val to_string : t -> string