13 citations · 13 across the 2 of their papers we have counts for
2 papers
physics.chem-ph2024
Accelerating Fock build via hybrid analytical-numerical integration
Yong Zhang, Rongding Lei, Bingbing Suo +1
A very robust and efficient hybrid analytic-numerical Fock build, aMECP+aCOSx, has been developed for accelerating HF/DFT calculations. The essential idea is to extract those porti…
physics.chem-ph2022★ 13 cited
Self-Adaptive Real-Time Time-Dependent Density Functional Theory for X-ray Absorptions
Linfeng Ye, Hao Wang, Yong Zhang +1
Real-time time-dependent density functional theory (RT-TDDFT) can in principle access the whole absorption spectrum of a many-electron system exposed to a narrow pulse. However, th…