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23 lines
416 B
OCaml
23 lines
416 B
OCaml
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(* When an xyz file is read by =xyz_parser.mly=, it is converted into
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* an ~xyz_file~ data structure. *)
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(* [[file:../nuclei.org::*Parser][Parser:2]] *)
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open Common
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type nucleus =
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{
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element: Element.t ;
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coord : Coordinate.angstrom Coordinate.point;
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}
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type xyz_file =
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{
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number_of_atoms : int ;
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file_title : string ;
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nuclei : nucleus list ;
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}
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(* Parser:2 ends here *)
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