2 papers
cond-mat.mtrl-sci2024
A Recursive Hybrid Tetrahedron Method for Brillouin-zone Integration
Kun Dong, Yihao Lin, Xiaoqiang Liu +2
A recursive extension of the hybrid tetrahedron method for Brillouin-zone integration is proposed, allowing iterative tetrahedron refinement and significantly reducing the error fr…
physics.chem-ph2022
Identification of the decay pathway of photoexcited nucleobases
Xiangxu Mu, Ming Zhang, Jiechao Feng +6
The identification of the decay pathway of the nucleobase uracil after being photoexcited by ultraviolet (UV) light has been a long standing problem. Various theoretical models hav…