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- a -
add() :
Map< T >
,
Neighbor_List
add_diags10_nostrain() :
TB_Model_spdsstar
add_longrange() :
Coulomb_Matrix_Elements_Calculator
add_path() :
K_Point_List
add_shifted() :
Neighbor_List
add_straincorrection() :
TB_Model_spdsstar
apply_trafo() :
Coulomb_Matrix_Elements
approx_rect() :
PPF_TB_Fit
- b -
Barrier() :
Communicator
,
MPI_Communicator
bbox() :
Atom_List
- c -
calc_dist() :
Lattice
calcualte_unrelaxed_single() :
Neighbor_List
calculate() :
Neighbor_List
calculate_alpha_beta_Kramers_sz() :
Eigenvector_Printer_SLEPc
calculate_unrelaxed() :
Neighbor_List
cartesian_from_lattice_units() :
Lattice
check_consistency() :
Coulomb_Matrix_Elements
check_Hermitian() :
Coulomb_Matrix_Elements
check_size_consistency() :
Coulomb_Matrix_Elements
clone() :
Finite_Manybody_Hilbert_Space
,
Selected_Manybody_Hilbert_Space
copy() :
Selected_Manybody_Hilbert_Space
- d -
dump_sparse_Matrix() :
Sparse_Matrix_Generator
- f -
fct() :
Function_Template< T >
,
Function_Template_along_Axis< T >
,
Function_Template_from_Multivar< T >
,
Multivar_Function_Template< T >
,
Parameter_Pointer_Function
,
PPF_TB_Fit
,
PPF_Test_Parabola
- g -
generate_from_lattice() :
Atom_List
get_diags10_nostrain() :
TB_Model_spdsstar
get_DIM() :
Parameter_Pointer_Function
,
VFF
get_dim_e() :
Finite_Manybody_Hilbert_Space
get_first_bondlength() :
Lattice
get_k() :
K_Point_List
get_Matrix_row_block() :
Hartree_Fock
,
Manybody_Hamiltonian
,
Sparse_Matrix_Generator
,
Sparse_Matrix_Generator_From_File
,
TB_Model_Slater_Koster
,
TB_Model_spdsstar
get_nr_at() :
TB_Model
,
TB_Model_Slater_Koster
,
TB_Model_spdsstar
get_offdiagonals() :
TB_Model_spdsstar
get_params() :
Parameter_Pointer_Function
get_rank_e() :
Manybody_Hilbert_Space
get_row_passivate_graphene() :
TB_Model_Slater_Koster
get_surface_block() :
TB_Model_spdsstar
- h -
has_Kramers_partner() :
Eigenvector_Printer_SLEPc
- i -
is_Full_Hilbert_Space() :
Finite_Manybody_Hilbert_Space
,
Manybody_Hilbert_Space
is_hole() :
Coulomb_Matrix_Elements
- m -
make_Hermitian() :
Coulomb_Matrix_Elements
MPI_Reduce_to_Node0() :
Coulomb_Matrix_Elements_Calculator
- n -
new_Distribute_Block_Local() :
Abstract_Solver
,
SLEPc_Solver
- o -
operator()() :
Function_Template< T >
,
Multivar_Function_Template< T >
orbitals_are_set_up() :
Distribute_EV_List
- p -
plot() :
Function_Template< T >
print() :
Atom_List
,
K_Point_List
print_atoms() :
Sample
- r -
read() :
Atom_List
,
Coulomb_Matrix_Elements
,
Distribute_EV_List
,
K_Point_List
read_atoms() :
Sample
read_EV() :
Single_Particle_Eigenvectors
Reduce_Max_Double() :
Communicator
,
MPI_Communicator
Reduce_Sum_Complex() :
Communicator
,
MPI_Communicator
- s -
set_initial_vec() :
VFF
set_params() :
Parameter_Pointer_Function
setup() :
Atom_List
,
Band_Structure
,
Distribute_EV_List
,
Eigenvector_Printer
,
K_Point_List
,
Neighbor_List
,
Single_Particle_Eigenvectors
,
TB_Model
,
TB_Model_Slater_Koster
,
TB_Model_spdsstar
setup_from_resdir_and_posfile() :
VFF
setup_orbitals() :
Distribute_EV_List
- v -
Vec3d() :
Vec3d
VVF_FunctionAndGradient() :
VFF
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