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Changed comment in reference_local_host_work_driver.cxx to use refere…
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…nce DOI
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elambros committed Aug 9, 2023
1 parent afb24bb commit 3f50ef2
Showing 1 changed file with 2 additions and 2 deletions.
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Expand Up @@ -261,8 +261,8 @@ void ReferenceLocalHostWorkDriver::eval_uvvar_gga_uks( size_t npts, size_t nbe,
const double factp = 0.5 * vrho[2*i];
const double factm = 0.5 * vrho[2*i+1];


GauXC::blas::scal( nbf, 0.5*(factp + factm), z_col, 1 ); //additional 0.5 is from eq 56 in petrone 2018 eur phys journal b "an efficent implementation of .. "
//eq. 56 https://doi.org/10.1140/epjb/e2018-90170-1
GauXC::blas::scal( nbf, 0.5*(factp + factm), z_col, 1 );
GauXC::blas::scal( nbf, 0.5*(factp - factm), z_col2, 1 );

}
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