integrals_2el_exchange.h File Reference

#include "basisinfo.h"
#include "integrals_2el.h"
#include "csr_matrix.h"

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Functions

int compute_K_by_boxes (const BasisInfoStruct &basisInfo, const IntegralInfo *integralInfo, const JK::ExchWeights &CAM_params_in, const JK::Params &J_K_params, ergo_real *K, csr_matrix_struct *K_CSR, const ergo_real *dens, csr_matrix_struct *densCSR, int symmetryFlag)


Function Documentation

int compute_K_by_boxes ( const BasisInfoStruct basisInfo,
const IntegralInfo integralInfo,
const JK::ExchWeights CAM_params_in,
const JK::Params J_K_params,
ergo_real K,
csr_matrix_struct K_CSR,
const ergo_real dens,
csr_matrix_struct densCSR,
int  symmetryFlag 
)


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