occ::dma::LinearDMASettings Struct Reference

Settings for linear multipole analysis. More...

#include <linear_multipole_calculator.h>

Public Attributes
int	max_rank = 4
bool	include_nuclei = true
bool	use_slices = false
double	tolerance = 2.30258 * 18
double	default_radius = 0.5
double	hydrogen_radius = 0.325

Detailed Description

Settings for linear multipole analysis.

Member Data Documentation

default_radius

double occ::dma::LinearDMASettings::default_radius = 0.5

hydrogen_radius

double occ::dma::LinearDMASettings::hydrogen_radius = 0.325

include_nuclei

bool occ::dma::LinearDMASettings::include_nuclei = true

max_rank

int occ::dma::LinearDMASettings::max_rank = 4

tolerance

double occ::dma::LinearDMASettings::tolerance = 2.30258 * 18

use_slices

bool occ::dma::LinearDMASettings::use_slices = false

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

• /home/runner/work/occ/occ/include/occ/dma/linear_multipole_calculator.h