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linear_multipole_calculator.h File Reference
#include <occ/core/linear_algebra.h>
#include <occ/dma/mult.h>
#include <occ/qm/wavefunction.h>
#include <unsupported/Eigen/CXX11/Tensor>
#include <vector>
Include dependency graph for linear_multipole_calculator.h:

Classes

struct  occ::dma::LinearDMASettings
 Settings for linear multipole analysis. More...
 
class  occ::dma::LinearMultipoleCalculator
 Calculator for distributed multipole analysis of linear molecules. More...
 

Namespaces

namespace  occ
 
namespace  occ::dma