source: ThirdParty/mpqc_open/src/lib/chemistry/qc/cints/storage.cc@ 7516f6

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Last change on this file since 7516f6 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: 2.0 KB
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1//
2// storage.cc
3//
4// Copyright (C) 2001 Edward Valeev
5//
6// Author: Edward Valeev <edward.valeev@chemistry.gatech.edu>
7// Maintainer: EV
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#ifdef __GNUG__
29#pragma implementation
30#endif
31
32#include <util/misc/formio.h>
33#include <chemistry/qc/basis/integral.h>
34#include <chemistry/qc/cints/int2e.h>
35#include <chemistry/qc/cints/storage.h>
36
37using namespace std;
38using namespace sc;
39
40inline int max(int a,int b) { return (a > b) ? a : b;}
41inline void fail()
42{
43 ExEnv::errn() << scprintf("failing module:\n%s",__FILE__) << endl;
44 abort();
45}
46
47void
48Int2eCints::init_storage(size_t size)
49{
50 if (size) storage_ = size;
51 else storage_ = 0;
52}
53
54void
55Int2eCints::done_storage()
56{
57 storage_ = 0;
58}
59
60
61void
62Int2eCints::check_storage_() const
63{
64 // if (storage_used_ > storage_) {
65 // ExEnv::err() << scprintf("Not enough storage allowed for integrals evaluators:") << endl;
66 // ExEnv::err() << scprintf("storage_ = %ld",storage_) << endl;
67 // ExEnv::err() << scprintf("storage_used_ = %ld",storage_used_) << endl;
68 // abort();
69 // }
70}
71
72/////////////////////////////////////////////////////////////////////////////
73
74// Local Variables:
75// mode: c++
76// c-file-style: "CLJ-CONDENSED"
77// End:
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