23 citations · 46 across the 8 of their papers we have counts for
4 papers · 1 filter
Performance assessment of the effective core potentials under the Fermionic neural network: first and second row elements
Mengsa Wang, Yuzhi Zhou, Han Wang
The rapid development of deep learning techniques has driven the emergence of a neural network-based variational Monte Carlo method (referred to as FermiNet), which has manifested…
An extended plane wave framework for the electronic structure calculations of twisted bilayer material systems
Xiaoying Dai, Aihui Zhou, Yuzhi Zhou
In this paper, we propose an extended plane wave framework to make the electronic structure calculations of the twisted bilayer 2D material systems practically feasible. Based on t…
Layer-splitting methods for time-dependent Schrödinger equations of incommensurate systems
Ting Wang, Huajie Chen, Aihui Zhou +1
This work considers numerical methods for the time-dependent Schrödinger equation of incommensurate systems. By using a plane wave method for spatial discretization, the incommensu…
A plane wave study on the localized-extended transitions in the one-dimensional incommensurate systems
Huajie Chen, Aihui Zhou, Yuzhi Zhou
Based on our recently proposed plane wave framework, we theoretically study the localized-extended transition in the one dimensional incommensurate systems with cosine type of pote…