LIBINT
2.1.0-stable
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Transformation coefficients from unnormalized Cartesian Gaussians (rows) to unit-normalized real Solid Harmonics Gaussians. More...
#include <solidharmonics.h>
Public Types | |
typedef ::libint2::real_t | real_t |
Public Member Functions | |
SolidHarmonicsCoefficients (unsigned char l) | |
SolidHarmonicsCoefficients (SolidHarmonicsCoefficients &&other) | |
SolidHarmonicsCoefficients (const SolidHarmonicsCoefficients &other)=default | |
void | init (unsigned char l) |
const Real * | row_values (size_t r) const |
returns ptr to row values | |
const unsigned char * | row_idx (size_t r) const |
returns ptr to row indices | |
unsigned char | nnz (size_t r) const |
number of nonzero elements in row r | |
Static Public Member Functions | |
static const SolidHarmonicsCoefficients & | instance (unsigned int l) |
Transformation coefficients from unnormalized Cartesian Gaussians (rows) to unit-normalized real Solid Harmonics Gaussians.