MPQC
3.0.0-alpha
parenthesis2q.h
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//
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// parenthesis2q.h --- base class for (2)Q corrections
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//
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// Copyright (C) 2009 Toru Shiozaki
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//
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// Author: Toru Shiozaki <shiozaki.toru@gmail.com>
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// Maintainer: TS
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//
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// This file is part of the SC Toolkit.
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//
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// The SC Toolkit is free software; you can redistribute it and/or modify
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// it under the terms of the GNU Library General Public License as published by
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// the Free Software Foundation; either version 2, or (at your option)
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// any later version.
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//
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// The SC Toolkit is distributed in the hope that it will be useful,
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// but WITHOUT ANY WARRANTY; without even the implied warranty of
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// MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
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// GNU Library General Public License for more details.
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//
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// You should have received a copy of the GNU Library General Public License
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// along with the SC Toolkit; see the file COPYING.LIB. If not, write to
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// the Free Software Foundation, 675 Mass Ave, Cambridge, MA 02139, USA.
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//
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// The U.S. Government is granted a limited license as per AL 91-7.
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//
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#ifndef _chemistry_qc_ccr12_parenthesis2q_h
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#define _chemistry_qc_ccr12_parenthesis2q_h
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#include <util/ref/ref.h>
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#include <chemistry/qc/ccr12/ccr12_info.h>
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#include <chemistry/qc/ccr12/parenthesis2tnum.h>
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namespace
sc
{
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class
Parenthesis2q
:
public
RefCount
{
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protected
:
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CCR12_Info
* z;
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public
:
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Parenthesis2q
(
CCR12_Info
* );
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~
Parenthesis2q
();
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double
compute_energy(
Ref<Parenthesis2tNum>
,
Ref<Parenthesis2tNum>
);
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};
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}
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#endif
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sc::Ref
A template class that maintains references counts.
Definition:
ref.h:361
sc::Parenthesis2q
Definition:
parenthesis2q.h:37
sc::RefCount
The base class for all reference counted objects.
Definition:
ref.h:192
sc
Contains all MPQC code up to version 3.
Definition:
mpqcin.h:14
sc::CCR12_Info
CCR12_Info is the compilation of members that are used in CC and CC-R12 methods.
Definition:
ccr12_info.h:50
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