source: ThirdParty/mpqc_open/src/lib/chemistry/qc/basis/files.h

Candidate_v1.6.1
Last change on this file was 860145, checked in by Frederik Heber <heber@…>, 8 years ago

Merge commit '0b990dfaa8c6007a996d030163a25f7f5fc8a7e7' as 'ThirdParty/mpqc_open'

  • Property mode set to 100644
File size: 1.4 KB
Line 
1//
2// files.h
3//
4// Copyright (C) 1996 Limit Point Systems, Inc.
5//
6// Author: Curtis Janssen <cljanss@limitpt.com>
7// Maintainer: LPS
8//
9// This file is part of the SC Toolkit.
10//
11// The SC Toolkit is free software; you can redistribute it and/or modify
12// it under the terms of the GNU Library General Public License as published by
13// the Free Software Foundation; either version 2, or (at your option)
14// any later version.
15//
16// The SC Toolkit is distributed in the hope that it will be useful,
17// but WITHOUT ANY WARRANTY; without even the implied warranty of
18// MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
19// GNU Library General Public License for more details.
20//
21// You should have received a copy of the GNU Library General Public License
22// along with the SC Toolkit; see the file COPYING.LIB. If not, write to
23// the Free Software Foundation, 675 Mass Ave, Cambridge, MA 02139, USA.
24//
25// The U.S. Government is granted a limited license as per AL 91-7.
26//
27
28#ifndef _chemistry_qc_basis_h
29#define _chemistry_qc_basis_h
30
31#include <util/keyval/keyval.h>
32
33namespace sc {
34
35class BasisFileSet {
36 private:
37 char *dir_[2];
38 char **basissets_;
39 int nbasissets_;
40 public:
41 BasisFileSet(const Ref<KeyVal>&);
42 ~BasisFileSet();
43 Ref<KeyVal> keyval(const Ref<KeyVal>&, const char *name);
44};
45
46}
47
48#endif
49
50// Local Variables:
51// mode: c++
52// c-file-style: "CLJ"
53// End:
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