PAWpySeed
Parallel C/Python package for numerical analysis of PAW DFT wavefunctions
Public Attributes | List of all members
kpoint Struct Reference

#include <utils.h>

Collaboration diagram for kpoint:
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Public Attributes

short int up
 spin More...
 
int num_waves
 number of plane waves in a band More...
 
int * Gs
 plane wave coefficients, in sets of three More...
 
double * k
 k-point vector More...
 
double weight
 k-point weight More...
 
int num_bands
 number of bands More...
 
band_t ** bands
 bands with this k-point More...
 
rayleigh_set_t ** expansion
 

Member Data Documentation

band_t** kpoint::bands

bands with this k-point

rayleigh_set_t** kpoint::expansion
int* kpoint::Gs

plane wave coefficients, in sets of three

double* kpoint::k

k-point vector

int kpoint::num_bands

number of bands

int kpoint::num_waves

number of plane waves in a band

short int kpoint::up

spin

double kpoint::weight

k-point weight


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