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20162023
most citedLattice Dynamics Calculations based on Density-functional Perturbation Theory in Real Space

68 citations · 203 across the 17 of their papers we have counts for

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physics.chem-ph2021

Localized resolution of identity approach to the analytical gradients of random-phase approximation ground-state energy: algorithm and benchmarks

Muhammad N. Tahir, Tong Zhu, Honghui Shang +3

We develop and implement a formalism which enables calculating the analytical gradients of particle-hole random-phase approximation (RPA) ground-state energy with respect to the at…