PTEROSOR/QuantumPackage
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Foce ao_normalized=true for qp_create

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Anthony Scemama 2025-02-18 11:36:56 +01:00
parent a1ff1a3efc
commit d04232bb7b
1 changed files with 1 additions and 0 deletions
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ocaml/qp_create_ezfio.ml
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@ -267,6 +267,7 @@ let run ?o b au c d m p cart xyz_file =
(* Create EZFIO *)
Ezfio.set_file ezfio_file;
Ezfio.set_ezfio_files_ezfio_convention 20250211;
Ezfio.set_basis_ao_normalized true ;
(* Write Pseudo *)
let pseudo =