Psi4
wrapper.h
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1 /*
2  * @BEGIN LICENSE
3  *
4  * Psi4: an open-source quantum chemistry software package
5  *
6  * Copyright (c) 2007-2017 The Psi4 Developers.
7  *
8  * The copyrights for code used from other parties are included in
9  * the corresponding files.
10  *
11  * This file is part of Psi4.
12  *
13  * Psi4 is free software; you can redistribute it and/or modify
14  * it under the terms of the GNU Lesser General Public License as published by
15  * the Free Software Foundation, version 3.
16  *
17  * Psi4 is distributed in the hope that it will be useful,
18  * but WITHOUT ANY WARRANTY; without even the implied warranty of
19  * MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
20  * GNU Lesser General Public License for more details.
21  *
22  * You should have received a copy of the GNU Lesser General Public License along
23  * with Psi4; if not, write to the Free Software Foundation, Inc.,
24  * 51 Franklin Street, Fifth Floor, Boston, MA 02110-1301 USA.
25  *
26  * @END LICENSE
27  */
28 
29 #ifndef SAPTENERGY_H
30 #define SAPTENERGY_H
31 
32 #include "psi4/psi4-dec.h"
33 #include "psi4/libmints/typedefs.h"
34 
35 namespace psi {
36 class Options;
37 
38 namespace sapt {
39 
41  SharedWavefunction MonomerB, Options & options);
42 
43 }}
44 
45 #endif
PsiReturnType
Definition: psi4-dec.h:46
PsiReturnType sapt(SharedWavefunction, SharedWavefunction, SharedWavefunction, Options &)
Definition: sapt/wrapper.cc:48
std::shared_ptr< Wavefunction > SharedWavefunction
Definition: typedefs.h:54