CheMPS2
TensorL.h
1 /*
2  CheMPS2: a spin-adapted implementation of DMRG for ab initio quantum chemistry
3  Copyright (C) 2013-2016 Sebastian Wouters
4 
5  This program is free software; you can redistribute it and/or modify
6  it under the terms of the GNU General Public License as published by
7  the Free Software Foundation; either version 2 of the License, or
8  (at your option) any later version.
9 
10  This program is distributed in the hope that it will be useful,
11  but WITHOUT ANY WARRANTY; without even the implied warranty of
12  MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
13  GNU General Public License for more details.
14 
15  You should have received a copy of the GNU General Public License along
16  with this program; if not, write to the Free Software Foundation, Inc.,
17  51 Franklin Street, Fifth Floor, Boston, MA 02110-1301 USA.
18 */
19 
20 #ifndef TENSORL_CHEMPS2_H
21 #define TENSORL_CHEMPS2_H
22 
23 #include "TensorT.h"
24 #include "TensorO.h"
25 
26 namespace CheMPS2{
32  class TensorL : public TensorOperator{
33 
34  public:
35 
37 
42  TensorL( const int boundary_index, const int Idiff, const bool moving_right, const SyBookkeeper * book_up, const SyBookkeeper * book_down );
43 
45  virtual ~TensorL();
46 
48 
49  void create( TensorT * mps_tensor );
50 
52 
56  void create( TensorT * mps_tensor_up, TensorT * mps_tensor_down, TensorO * previous, double * workmem );
57 
58  private:
59 
61  void create_right( const int ikappa, TensorT * mps_tensor_up, TensorT * mps_tensor_down, TensorO * previous, double * workmem );
62 
64  void create_left( const int ikappa, TensorT * mps_tensor_up, TensorT * mps_tensor_down, TensorO * previous, double * workmem );
65 
66  };
67 }
68 
69 #endif
void create(TensorT *mps_tensor)
Create a new TensorL.
Definition: TensorL.cpp:41
Definition: CASPT2.h:42
TensorL(const int boundary_index, const int Idiff, const bool moving_right, const SyBookkeeper *book_up, const SyBookkeeper *book_down)
Constructor.
Definition: TensorL.cpp:28
bool moving_right
Whether or not moving right.
virtual ~TensorL()
Destructor.
Definition: TensorL.cpp:39