30 citations · 36 across the 2 of their papers we have counts for
4 papers
Real-time exciton dynamics with time-dependent density-functional theory
Jiuyu Sun, Cheng-Wei Lee, Alina Kononov +2
Linear-response time-dependent density-functional theory (TDDFT) can describe excitonic features in the optical spectra of insulators and semiconductors, using exchange-correlation…
Optical properties of CsCuX (X=Cl, Br and I): A comparative study between hybrid time-dependent density-functional theory and the Bethe-Salpeter equation
Jiuyu Sun, Carsten A. Ullrich
The cesium copper halides CsCuX (X=Cl, Br and I) are a class of all-inorganic perovskites with interesting and potentially useful optical properties, characterized by disti…
Two-dimensional Penta-Pt2N4: an ideal material for nanoelectronics
Zhao Liu, Haidi Wang, Jiuyu Sun +2
Since the discovery of graphene, two-dimensional (2D) materials have paved a new routine for designing high-performance nanoelectronic devices. To facilitate the device application…
BP_5 Monolayer with Multiferroicity and Negative Poisson's Ratio: A Prediction by Global Optimization Method
Haidi Wang, Xingxing Li, Jiuyu Sun +2
Based on variable components global optimization algorithm, we predict a stable two-dimensional (2D) phase of boron phosphide with 1:5 stoichiometry, i.e. boron pentaphosphide (BP_…