(* Type * * #+NAME: types *) (* [[file:~/QCaml/particles/electrons.org::types][types]] *) type t (* types ends here *) (* Creation *) (* [[file:~/QCaml/particles/electrons.org::*Creation][Creation:1]] *) open Common val make : int -> int -> t val of_atoms : ?multiplicity:int -> ?charge:int -> Nuclei.t -> t (* @param multiplicity default is 1 @param charge default is 0 @raise Invalid_argument if the spin multiplicity is not compatible with the molecule and the total charge. *) (* Creation:1 ends here *) (* Access *) (* [[file:~/QCaml/particles/electrons.org::*Access][Access:1]] *) val charge : t -> Charge.t val n_elec : t -> int val n_alfa : t -> int val n_beta : t -> int val multiplicity : t -> int (* Access:1 ends here *) (* Printers *) (* [[file:~/QCaml/particles/electrons.org::*Printers][Printers:1]] *) val pp : Format.formatter -> t -> unit (* Printers:1 ends here *)