29.3k citations · 37.7k across the 22 of their papers we have counts for
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cond-mat.mtrl-sci2021★ 22 cited
Electron energy loss spectroscopy of bulk gold with ultrasoft pseudopotentials and the Liouville-Lanczos method
Oleksandr Motornyi, Nathalie Vast, Iurii Timrov +3
The implementation of ultrasoft pseudopotentials into time-dependent density-functional perturbation theory is detailed for both the Sternheimer approach and the Liouville-Lanczos…
cond-mat.mtrl-sci2021★ 29 cited
Quasi-harmonic thermoelasticity of palladium, platinum, copper, and gold from first principles
Cristiano Malica, Andrea Dal Corso
We calculate the temperature-dependent elastic constants of palladium, platinum, copper and gold within the quasi-harmonic approximation using a first-principles approach and evalu…