PAWpySeed
Parallel C/Python package for numerical analysis of PAW DFT wavefunctions
Variables
gaunt.h File Reference

Go to the source code of this file.

Variables

double GAUNT_COEFF [4][4][4][7][4]
 
double SBTFACS [4][4][4][7][4]
 

Detailed Description

Stores gaunt coefficients and offsite overlap integral factors. Access as l1, l2, (L-|l1-l2|)/2, l1+m1, m2. Constrained by l1 >= l2, m2 >= 0, L >= |l1-l2|, L <= l1+l2

Variable Documentation

double GAUNT_COEFF[4][4][4][7][4]
double SBTFACS[4][4][4][7][4]