votca::xtp::TrapFinder::Trap Struct Reference

#include <trapfinder.h>

Collaboration diagram for votca::xtp::TrapFinder::Trap:

Public Attributes
std::vector< Index >	sites
double	weight = 0.0
double	relaxation_rate = 0.0
double	release_rate = 0.0
double	capture_rate = 0.0
double	hop_rate = 0.0

Detailed Description

Definition at line 85 of file trapfinder.h.

Member Data Documentation

capture_rate

double votca::xtp::TrapFinder::Trap::capture_rate = 0.0

Definition at line 93 of file trapfinder.h.

hop_rate

double votca::xtp::TrapFinder::Trap::hop_rate = 0.0

equilibrium flux of hops out of the trap per occupation (1/s); much larger than release_rate when the carrier mostly hops back

Definition at line 96 of file trapfinder.h.

relaxation_rate

double votca::xtp::TrapFinder::Trap::relaxation_rate = 0.0

relaxation rate of the slow mode that found the trap (1/s); in the two-state picture of the mode it is release + capture rate, and the weight is capture / (release + capture):

Definition at line 91 of file trapfinder.h.

release_rate

double votca::xtp::TrapFinder::Trap::release_rate = 0.0

Definition at line 92 of file trapfinder.h.

sites

std::vector<Index> votca::xtp::TrapFinder::Trap::sites

Definition at line 86 of file trapfinder.h.

weight

double votca::xtp::TrapFinder::Trap::weight = 0.0

Definition at line 87 of file trapfinder.h.

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The documentation for this struct was generated from the following file:

• xtp/include/votca/xtp/trapfinder.h