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cond-mat.mtrl-sci2018★ 711 cited
Atomic and electronic reconstruction at van der Waals interface in twisted bilayer graphene
Hyobin Yoo, Rebecca Engelke, Stephen Carr +14
Control of the interlayer twist angle in two-dimensional (2D) van der Waals (vdW) heterostructures enables one to engineer a quasiperiodic moiré superlattice of tunable length scal…
cond-mat.mtrl-sci2017
Compression of Wannier functions into Gaussian-type orbitals
Bakhta Athmane, Cancès Eric, Cazeaux Paul +2
We propose a greedy algorithm for the compression of Wannier functions into Gaussian-polynomials orbitals. The so-obtained compressed Wannier functions can be stored in a very comp…