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47 changes: 47 additions & 0 deletions source/_data/pub.bib
Original file line number Diff line number Diff line change
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@Article{Yang_PhysRevB_2024_v110_p235410,
author = {Shengguo Yang and Jiaxin Chen and Chao-Fei Liu and Mingxing Chen},
title = {{Evolution of flat bands in MoSe2/WSe2 moir{\'e} lattices: A study
combining machine learning and band unfolding methods}},
journal = {Phys. Rev. B},
year = 2024,
volume = 110,
number = 23,
pages = 235410,
doi = {10.1103/PhysRevB.110.235410},
abstract = {Moir{\textbackslash}'e lattices have served as the ideal quantum
simulation platform for exploring novel physics due to the flat
electronic bands resulting from the long wavelength
moir{\textbackslash}'e potentials. However, the large sizes of this
type of system challenge the first-principles methods for full
calculations of their electronic structures, thus bringing
difficulties in understanding the nature and evolution of the flat
bands. In this study, we investigate the electronic structures of
moir{\textbackslash}'e patterns of MoSe{\$}{\_}2{\$}/WSe{\$}{\_}2{\$}
by combining ab initio and machine learning methods. We find that a
flat band with a bandwidth of about 5 meV emerges below the valence
band edge at the K point for the H-stacking at a twist angle of
3.89{\$}{\textasciicircum}{\{}{\textbackslash}circ{\}}{\$} without
spin-orbit coupling effect. Then, it shifts dramatically as the twist
angle decreases and becomes about 20 meV higher than the valence band
maximum for the twist angle of
3.15{\$}{\textasciicircum}{\{}{\textbackslash}circ{\}}{\$}. Multiple
ultra-flat bands emerge as the twist angle is reduced to
1.7{\$}{\textasciicircum}{\{}{\textbackslash}circ{\}}{\$}. The spin-
orbit coupling leads to a giant spin splitting comparable to that
observed in the untwisted system (about 0.45 eV) and is nearly
independent of twisting and stacking. As a result, the K-valley flat
band remains the valence band maximum with the inclusion of spin-orbit
coupling. Band unfolding reveals that the ultra-flat bands formed by
the {\$}{\textbackslash}Gamma{\$} and K valleys show distinct
behaviors. The {\$}{\textbackslash}Gamma{\$}-valley flat bands are
sensitive to the interlayer coupling, thus experiencing dramatic
changes as the twist angle decreases. In contrast, the K-valley flat
band, which shows a weak dependence on the interlayer coupling, is
mainly modulated by structural reconstruction. Therefore, a relatively
small angle
(2.13{\$}{\textasciicircum}{\{}{\textbackslash}circ{\}}{\$}) is
required to generate the K-valley flat band, which experiences a
transition from the honeycomb to the triangular lattice as the twist
angle decreases.},
}

@Article{Tang_NatCommun_2024_v15_p8815,
author = {Zechen Tang and He Li and Peize Lin and Xiaoxun Gong and Gan Jin and
Lixin He and Hong Jiang and Xinguo Ren and Wenhui Duan and Yong Xu},
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