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16 lines
278 B
OCaml
16 lines
278 B
OCaml
(** Guess for Hartree-Fock calculations. *)
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type guess =
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| Hcore of Lacaml.D.Mat.t
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| Huckel of Lacaml.D.Mat.t
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type t = guess
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val make : ?nocc:int -> guess:[ `Hcore | `Huckel ] -> AOBasis.t -> t
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(** {2 Tests} *)
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val test_case : AOBasis.t -> unit Alcotest.test_case list
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