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cond-mat.mtrl-sci2026
Accurate and efficient simulation of photoemission spectroscopy via Kohn-Sham scattering states
Gian Parusa, Sotirios Fragkos, Samuel Beaulieu +1
We introduce an efficient first-principles framework for simulating angle-resolved photoemission spectroscopy (ARPES) based on the direct computation of photoelectron states as sol…
cond-mat.mtrl-sci2024★ 1 cited
First-principle tight-binding approach to angle-resolved photoemission spectroscopy simulations: importance of light-matter gauge and ubiquitous interference effects
Yun Yen, Gian Parusa, Michael Schüler
Angle-resolved photoemission spectroscopy (ARPES) is one of the most powerful techniques to study the electronic structure of materials. To go beyond the paradigm of band mapping a…