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https://github.com/LCPQ/quantum_package
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31 lines
770 B
OCaml
31 lines
770 B
OCaml
module Hole :
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sig
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type t
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val to_mo_class : t -> MO_class.t
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val of_mo_class : MO_class.t -> t
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val t_of_sexp : Sexplib.Sexp.t -> t
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val sexp_of_t : t -> Sexplib.Sexp.t
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end
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module Particle :
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sig
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type t
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val to_mo_class : t -> MO_class.t
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val of_mo_class : MO_class.t -> t
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val t_of_sexp : Sexplib.Sexp.t -> t
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val sexp_of_t : t -> Sexplib.Sexp.t
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end
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type t =
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| Single of Hole.t * Particle.t
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| Double of Hole.t * Particle.t * Hole.t * Particle.t
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[@@deriving sexp]
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val create_single : hole:MO_class.t -> particle:MO_class.t -> t
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val double_of_singles : t -> t -> t
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val create_double : hole1:MO_class.t -> particle1:MO_class.t ->
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hole2:MO_class.t -> particle2:MO_class.t -> t
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val to_string : t -> string
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