mirror of
https://github.com/QuantumPackage/qp2.git
synced 2024-11-14 18:13:51 +01:00
37 lines
909 B
OCaml
37 lines
909 B
OCaml
|
type t = S | P | D | F | G | H | I | J | K | L [@@deriving sexp]
|
||
|
|
|
||
|
|
(** Creatio from strings *)
|
||
|
|
val to_string : t -> string
|
||
|
|
val of_string : string -> t
|
||
|
|
val of_char : char -> t
|
||
|
|
|
||
|
|
(** Connexion with l quantum number *)
|
||
|
|
val to_l : t -> Qptypes.Positive_int.t
|
||
|
|
val of_l : Qptypes.Positive_int.t -> t
|
||
|
|
|
||
|
|
type st = t
|
||
|
|
module Xyz :
|
||
|
|
sig
|
||
|
|
type t = {
|
||
|
|
x : Qptypes.Positive_int.t;
|
||
|
|
y : Qptypes.Positive_int.t;
|
||
|
|
z : Qptypes.Positive_int.t;
|
||
|
|
} [@@deriving sexp]
|
||
|
|
|
||
|
|
(** The string format contains the powers of x,y and z in a
|
||
|
|
format like "x2z3" *)
|
||
|
|
|
||
|
|
val of_string : string -> t
|
||
|
|
val to_string : t -> string
|
||
|
|
|
||
|
|
(** Returns the quantum number l *)
|
||
|
|
val get_l : t -> Qptypes.Positive_int.t
|
||
|
|
|
||
|
|
(** Returns a list of XYZ powers for a given symmetry *)
|
||
|
|
val of_symmetry : st -> t list
|
||
|
|
|
||
|
|
(** Returns the symmetry corresponding to the XYZ powers *)
|
||
|
|
val to_symmetry : t -> st
|
||
|
|
|
||
|
|
end
|