mirror of
https://gitlab.com/scemama/QCaml.git
synced 2024-11-14 10:03:39 +01:00
22 lines
526 B
OCaml
22 lines
526 B
OCaml
(** Signature for matrices built on the {!Basis.t} *)
|
|
|
|
open Qcaml_gaussian_basis
|
|
open Qcaml_linear_algebra
|
|
|
|
type t = (Basis.t, Basis.t) Matrix.t
|
|
|
|
val of_basis : Basis.t -> t
|
|
(** Build from a {!Basis.t}. *)
|
|
|
|
val of_basis_pair : Basis.t -> Basis.t -> t
|
|
(** Build from a pair of {!Basis.t}. *)
|
|
|
|
val to_file : filename:string -> t -> unit
|
|
(** Write the integrals in a file. *)
|
|
|
|
val matrix : t -> (Basis.t, Basis.t) Matrix.t
|
|
(** Returns the matrix. *)
|
|
|
|
val of_matrix : (Basis.t, Basis.t) Matrix.t -> t
|
|
(** Build from a matrix. *)
|