19 citations · 27 across the 2 of their papers we have counts for
3 papers · 1 filter
Machine-learning models for Raman spectra analysis of twisted bilayer graphene
Natalya Sheremetyeva, Michael Lamparski, Colin Daniels +2
The vibrational properties of twisted bilayer graphene (tBLG) show complex features, due to the intricate energy landscape of its low-symmetry configurations. A machine learning-ba…
Vibrational and dielectric properties of the bulk transition metal dichalcogenides
Nicholas A. Pike, Antoine Dewandre, Benoit Van Troeye +2
Interest in the bulk transition metal dichalcogenides for their electronic, photovoltaic, and optical properties has grown and led to their use in many technological applications.…
First-principle study of paraelectric and ferroelectric CsHPO including dispersion forces: stability and related vibrational, dielectric and elastic properties
Benoit Van Troeye, Michiel Jan van Setten, Matteo Giantomassi +3
Using density functional theory (DFT) and density functional perturbation theory (DFPT), we investigate the stability and response functions of CsHPO, a ferroelectric mater…