params.h Source File
LibRPA
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params.h
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static double gf_R_threshold
threshold of R-space Green's function when construcing.
Definition: params.h:36
static std::string tfgrids_type
the type of time-frequency grids
Definition: params.h:27
static double libri_chi0_threshold_C
Cs threshold parsed to RPA object of LibRI.
Definition: params.h:53
static double sqrt_coulomb_threshold
threshold to filter when computing the square root of Coulomb matrix
Definition: params.h:45
static double libri_exx_threshold_C
Cs threshold parsed to EXX object of LibRI.
Definition: params.h:65
static std::string output_dir
the path of directory to store librpa output files
Definition: params.h:21
static bool replace_w_head
switch of replacing head of screened interaction by macroscopic dielectric function
Definition: params.h:83
static double libri_chi0_threshold_CSM
CS-matrix threshold parsed to RPA object of LibRI.
Definition: params.h:50
static int n_params_anacon
the number of parameters for analytic continuation
Definition: params.h:30
static int option_dielect_func
option of computing dielectric function on imaginary axis
Definition: params.h:92
static double cs_threshold
threshold of RI coefficient when parsing. The atomic block with maximal element smaller than it will ...
Definition: params.h:39
static bool output_gw_sigc_mat
switch of output correlation self-energy matrix
Definition: params.h:80
static std::string parallel_routing
type of parallel routing
Definition: params.h:33
static double libri_exx_threshold_CSM
CS-matrix threshold parsed to EXX object of LibRI.
Definition: params.h:62
static double libri_exx_threshold_V
Coulomb matrix threshold parsed to EXX object of LibRI.
Definition: params.h:71
static bool use_scalapack_gw_wc
switch of using ScaLAPACK for computing Wc from chi0
Definition: params.h:74
static bool use_scalapack_ecrpa
switch of using ScaLAPACK for EcRPA calculation
Definition: params.h:59
static double libri_chi0_threshold_G
Green's function threshold parsed to RPA object of LibRI.
Definition: params.h:56
static double vq_threshold
threshold of Coulomb matrix when parsing. The atom-pair block of Coulomb matrix with maximal element ...
Definition: params.h:42
static std::string output_file
the path of file to store librpa mainly output
Definition: params.h:18
static double libri_exx_threshold_D
Density matrix threshold parsed to EXX object of LibRI.
Definition: params.h:68
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