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Don't use pseudo by default

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Thomas Applencourt 2015-05-02 15:14:50 +02:00
parent cdc9f46428
commit ae4bc3d71b
1 changed files with 2 additions and 2 deletions
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4
ocaml/qp_create_ezfio_from_xyz.ml
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@ -13,8 +13,8 @@ let spec =
~doc:"int Total charge of the molecule. Default is 0."
+> flag "m" (optional_with_default 1 int)
~doc:"int Spin multiplicity (2S+1) of the molecule. Default is 1."
+> flag "p" (optional_with_default 1 int)
~doc:"Using pseudo potentiel or not"
+> flag "p" (optional_with_default 0 int)
~doc:"Using pseudo. Default is not (aka 0)"
+> anon ("xyz_file" %: string)
;;