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Performance of arsenene and antimonene double-gate MOSFETs from first principles
Giovanni Pizzi, Marco Gibertini, Elias Dib +3
In the race towards high-performance ultra-scaled devices, two-dimensional materials offer an alternative paradigm thanks to their atomic thickness suppressing short-channel effect…
Two-dimensional materials from high-throughput computational exfoliation of experimentally known compounds
Nicolas Mounet, Marco Gibertini, Philippe Schwaller +8
We search for novel two-dimensional materials that can be easily exfoliated from their parent compounds. Starting from 108423 unique, experimentally known three-dimensional compoun…
Band structure diagram paths based on crystallography
Yoyo Hinuma, Giovanni Pizzi, Yu Kumagai +2
Systematic and automatic calculations of the electronic band structure are a crucial component of computationally-driven high-throughput materials screening. An algorithm, for any…