source/integrals/multipole.cc File Reference

Code for computing multipole moments, and multipole interaction and translation matrices. More...

#include <memory.h>
#include <stdio.h>
#include <stdlib.h>
#include <math.h>
#include "multipole.h"
#include "output.h"
#include "integrals_general.h"

Functions

int compute_multipole_moments (const IntegralInfo &integralInfo, const DistributionSpecStruct *distr, multipole_struct_small *result)
int setup_multipole_maxAbsMomentList (multipole_struct_large *multipole)

Detailed Description

Code for computing multipole moments, and multipole interaction and translation matrices.

Author:
: Elias Rudberg responsible

Function Documentation

int compute_multipole_moments ( const IntegralInfo integralInfo,
const DistributionSpecStruct distr,
multipole_struct_small result 
)
int setup_multipole_maxAbsMomentList ( multipole_struct_large multipole  ) 

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