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cond-mat.mtrl-sci2020★ 2 cited
Critical analysis of the response function in low dimensional materials
Simon Divilov, Sara G. Mayo, Jose M. Soler +1
The presence of sharp peaks in the real part of the static dielectric response function are usually accepted as indication of charge or spin instabilities in a material. However, t…
cond-mat.mtrl-sci2018★ 27 cited
Band Unfolding Made Simple
Sara G. Mayo, Felix Yndurain, Jose M. Soler
We present a simple view on band unfolding of the energy bands obtained from supercell calculations. It relies on the relationship between the local density of states in reciprocal…