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20162026
most citedExamining real-time TDDFT non-equilibrium simulations for the calculation of electronic stopping power

80 citations · 347 across the 11 of their papers we have counts for

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physics.chem-ph2026

All-electron Dynamical Bethe-Salpeter Equation for Extended Systems with Atom-centered Orbital Basis

Ruiyi Zhou, Songrui Liu, Jianhang Xu +2

Solving Bethe-Salpeter equation (BSE) for the two-particle Green's function is the most widely used approach for taking into account the particle-hole (exciton) interaction in elec…

physics.chem-ph2022★ 22 cited

Exact constraints and appropriate norms in machine learned exchange-correlation functionals

Kanun Pokharel, James W. Furness, Yi Yao +4

Machine learning techniques have received growing attention as an alternative strategy for developing general-purpose density functional approximations, augmenting the historically…