MPQC 2.3.1

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types.h
1 //
2 // types.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_intv3_types_h
29 #define _chemistry_qc_intv3_types_h
30
31 #include <chemistry/qc/basis/gaussbas.h>
32
33 namespace sc {
34
35 /* Types that are used for integrals, but for which we don't need all
36 * of the sgen utilities, are defined here. */
37
38 class der_centersv3_t {
39 public:
40 int n;
41 GaussianBasisSet *cs[4];
42 int num[4];
43 GaussianBasisSet *ocs; /* The omitted center's centers_t. */
44 int onum; /* The omitted center's number. */
45 };
46
47 }
48
49 #endif
50
51 // Local Variables:
52 // mode: c++
53 // c-file-style: "CLJ"
54 // End: