CheMPS2
|
#include <TensorQ.h>
Public Member Functions | |
TensorQ (const int boundary_index, const int Idiff, const bool moving_right, const SyBookkeeper *denBK, const Problem *Prob, const int site) | |
Constructor. More... | |
virtual | ~TensorQ () |
Destructor. | |
void | AddTermSimple (TensorT *denT) |
Add terms after update/clear without previous tensors. More... | |
void | AddTermsL (TensorL **Ltensors, TensorT *denT, double *workmem, double *workmem2) |
Add terms after update/clear with previous TensorL's. More... | |
void | AddTermsAB (TensorOperator *denA, TensorOperator *denB, TensorT *denT, double *workmem, double *workmem2) |
Add terms after update/clear with previous A-tensors and B-tensors. More... | |
void | AddTermsCD (TensorOperator *denC, TensorOperator *denD, TensorT *denT, double *workmem, double *workmem2) |
Add terms after update/clear with previous C-tensors and D-tensors. More... | |
Public Member Functions inherited from CheMPS2::TensorOperator | |
TensorOperator (const int boundary_index, const int two_j, const int n_elec, const int n_irrep, const bool moving_right, const bool prime_last, const bool jw_phase, const SyBookkeeper *bk_up, const SyBookkeeper *bk_down) | |
Constructor. More... | |
virtual | ~TensorOperator () |
Destructor. | |
int | gNKappa () const |
Get the number of symmetry blocks. More... | |
double * | gStorage () |
Get the pointer to the storage. More... | |
int | gKappa (const int N1, const int TwoS1, const int I1, const int N2, const int TwoS2, const int I2) const |
Get the index corresponding to a certain tensor block. More... | |
int | gKappa2index (const int kappa) const |
Get the storage jump corresponding to a certain tensor block. More... | |
double * | gStorage (const int N1, const int TwoS1, const int I1, const int N2, const int TwoS2, const int I2) |
Get the pointer to the storage of a certain tensor block. More... | |
int | gIndex () const |
Get the boundary index. More... | |
int | get_2j () const |
Get twice the spin of the tensor operator. More... | |
int | get_nelec () const |
Get how many electrons there are more in the symmetry sector of the lower leg compared to the upper leg. More... | |
int | get_irrep () const |
Get the (real-valued abelian) point group irrep difference between the symmetry sectors of the lower and upper legs (see Irreps.h) More... | |
void | update (TensorOperator *previous, TensorT *mps_tensor_up, TensorT *mps_tensor_down, double *workmem) |
Clear and update. More... | |
void | daxpy (double alpha, TensorOperator *to_add) |
daxpy for TensorOperator More... | |
void | daxpy_transpose_tensorCD (const double alpha, TensorOperator *to_add) |
daxpy_transpose for C- and D-tensors (with special spin-dependent factors) More... | |
void | clear () |
Set all storage variables to 0.0. | |
double | inproduct (TensorOperator *buddy, const char trans) const |
Make the in-product of two TensorOperator. More... | |
Additional Inherited Members | |
Protected Member Functions inherited from CheMPS2::TensorOperator | |
void | update_moving_right (const int ikappa, TensorOperator *previous, TensorT *mps_tensor_up, TensorT *mps_tensor_down, double *workmem) |
Update moving right. More... | |
void | update_moving_left (const int ikappa, TensorOperator *previous, TensorT *mps_tensor_up, TensorT *mps_tensor_down, double *workmem) |
Update moving left. More... | |
Protected Attributes inherited from CheMPS2::TensorOperator | |
const SyBookkeeper * | bk_up |
The bookkeeper of the upper MPS. | |
const SyBookkeeper * | bk_down |
The bookkeeper of the lower MPS. | |
int | two_j |
Twice the spin of the tensor operator. | |
int | n_elec |
How many electrons there are more in the symmetry sector of the lower leg compared to the upper leg. | |
int | n_irrep |
The (real-valued abelian) point group irrep difference between the symmetry sectors of the lower and upper legs (see Irreps.h) | |
bool | moving_right |
Whether or not moving right. | |
int * | sector_nelec_up |
The up particle number sector. | |
int * | sector_irrep_up |
The up spin symmetry sector. | |
int * | sector_spin_up |
The up spin symmetry sector. | |
int * | sector_spin_down |
The down spin symmetry sector (pointer points to sectorTwoS1 if two_j == 0) | |
bool | prime_last |
Convention in which the tensor operator is stored (see class information) | |
bool | jw_phase |
Whether or not to include a Jordan-Wigner phase due to the fermion anti-commutation relations. | |
Protected Attributes inherited from CheMPS2::Tensor | |
int | index |
Index of the Tensor object. For TensorT: a site index; for other tensors: a boundary index. | |
double * | storage |
The actual variables. Tensor block kappa begins at storage+kappa2index[kappa] and ends at storage+kappa2index[kappa+1]. | |
int | nKappa |
Number of Tensor blocks. | |
int * | kappa2index |
kappa2index[kappa] indicates the start of tensor block kappa in storage. kappa2index[nKappa] gives the size of storage. | |
TensorQ class.
The TensorQ class is a storage and manipulation class for the complementary operator of three contracted creators/annihilitors.
CheMPS2::TensorQ::TensorQ | ( | const int | boundary_index, |
const int | Idiff, | ||
const bool | moving_right, | ||
const SyBookkeeper * | denBK, | ||
const Problem * | Prob, | ||
const int | site | ||
) |
Constructor.
boundary_index | The boundary index |
Idiff | The irrep of the one creator ( sandwiched if TensorL ; to sandwich if TensorQ ) |
moving_right | If true: sweep from left to right. If false: sweep from right to left |
denBK | Symmetry bookkeeper of the problem at hand |
Prob | Problem containing the matrix elements |
site | The site on which the last crea/annih should work |
Definition at line 27 of file TensorQ.cpp.
void CheMPS2::TensorQ::AddTermsAB | ( | TensorOperator * | denA, |
TensorOperator * | denB, | ||
TensorT * | denT, | ||
double * | workmem, | ||
double * | workmem2 | ||
) |
Add terms after update/clear with previous A-tensors and B-tensors.
denA | The A-tensor to construct the Q-term |
denB | The B-tensor to construct the Q-term |
denT | TensorT to construct the Q-term with previous TensorL's |
workmem | Work memory |
workmem2 | Work memory |
Definition at line 386 of file TensorQ.cpp.
void CheMPS2::TensorQ::AddTermsCD | ( | TensorOperator * | denC, |
TensorOperator * | denD, | ||
TensorT * | denT, | ||
double * | workmem, | ||
double * | workmem2 | ||
) |
Add terms after update/clear with previous C-tensors and D-tensors.
denC | The C-tensor to construct the Q-term |
denD | The D-tensor to construct the Q-term |
denT | TensorT to construct the Q-term with previous TensorL's |
workmem | Work memory |
workmem2 | Work memory |
Definition at line 601 of file TensorQ.cpp.
void CheMPS2::TensorQ::AddTermSimple | ( | TensorT * | denT | ) |
Add terms after update/clear without previous tensors.
denT | TensorT to construct the Q-term without previous tensors |
Definition at line 45 of file TensorQ.cpp.