source: ThirdParty/mpqc_open/src/lib/math/optimize/linkage.h@ 7516f6

Action_Thermostats Adding_MD_integration_tests Adding_StructOpt_integration_tests AutomationFragmentation_failures Candidate_v1.6.1 ChemicalSpaceEvaluator Enhanced_StructuralOptimization Enhanced_StructuralOptimization_continued Exclude_Hydrogens_annealWithBondGraph Fix_Verbose_Codepatterns ForceAnnealing_with_BondGraph ForceAnnealing_with_BondGraph_continued ForceAnnealing_with_BondGraph_continued_betteresults ForceAnnealing_with_BondGraph_contraction-expansion Gui_displays_atomic_force_velocity JobMarket_RobustOnKillsSegFaults JobMarket_StableWorkerPool PythonUI_with_named_parameters Recreated_GuiChecks StoppableMakroAction TremoloParser_IncreasedPrecision
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: 1.7 KB
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1//
2// linkage.h
3//
4// Copyright (C) 1996 Limit Point Systems, Inc.
5//
6// Author: Curtis Janssen <cljanss@ca.sandia.gov>
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 _math_optimize_linkage_h
29#define _math_optimize_linkage_h
30
31#include <math/optimize/qnewton.h>
32#include <math/optimize/newton.h>
33#include <math/optimize/gdiis.h>
34#include <math/optimize/efc.h>
35#include <math/optimize/steep.h>
36#include <math/optimize/update.h>
37#include <math/optimize/mcsearch.h>
38
39#include <math/scmat/linkage.h>
40
41namespace sc {
42
43static ForceLink<QNewtonOpt> optimize_force_link_a_;
44static ForceLink<GDIISOpt> optimize_force_link_b_;
45static ForceLink<EFCOpt> optimize_force_link_c_;
46static ForceLink<BFGSUpdate> optimize_force_link_d_;
47static ForceLink<PowellUpdate> optimize_force_link_e_;
48static ForceLink<SteepestDescentOpt> optimize_force_link_f_;
49static ForceLink<NewtonOpt> optimize_force_link_g_;
50static ForceLink<MCSearch> optimize_force_link_h_;
51
52}
53
54#endif
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