DFT-1/2 and shell DFT-1/2 methods: electronic structure calculation for semiconductors at LDA complexity

GQ Mao, ZY Yan, KH Xue, Z Ai, S Yang… - Journal of Physics …, 2022 - iopscience.iop.org
It is known that the Kohn–Sham eigenvalues do not characterize experimental excitation
energies directly, and the band gap of a semiconductor is typically underestimated by local …

Lead‐Free Halide Rb2CuBr3 as Sensitive X‐Ray Scintillator

B Yang, L Yin, G Niu, JH Yuan, KH Xue… - Advanced …, 2019 - Wiley Online Library
Scintillators are widely utilized for radiation detections in many fields, such as nondestructive
inspection, medical imaging, and space exploration. Lead halide perovskite scintillators …

[HTML][HTML] Paeoniflorin in Paeoniaceae: Distribution, influencing factors, and biosynthesis

XX Zhang, JQ Zuo, YT Wang, HY Duan… - Frontiers in Plant …, 2022 - frontiersin.org
Paeoniflorin, a monoterpene glucoside, is increasingly used in the clinical treatment of many
diseases because it has a variety of pharmacological activities. Besides, paeoniflorin has …

[HTML][HTML] Heteroepitaxial passivation of Cs2AgBiBr6 wafers with suppressed ionic migration for X-ray imaging

B Yang, W Pan, H Wu, G Niu, JH Yuan, KH Xue… - Nature …, 2019 - nature.com
X-ray detectors are broadly utilized in medical imaging and product inspection. Halide
perovskites recently demonstrate excellent performance for direct X-ray detection. However …

[HTML][HTML] Lead halide perovskite for efficient optoacoustic conversion and application toward high-resolution ultrasound imaging

X Du, J Li, G Niu, JH Yuan, KH Xue, M Xia… - Nature …, 2021 - nature.com
Lead halide perovskites have exhibited excellent performance in solar cells, LEDs and
detectors. Thermal properties of perovskites, such as heat capacity and thermal conductivity …

Ultra‐High Performance Amorphous Ga2O3 Photodetector Arrays for Solar‐Blind Imaging

Y Qin, LH Li, Z Yu, F Wu, D Dong, W Guo… - Advanced …, 2021 - Wiley Online Library
The growing demand for scalable solar‐blind image sensors with remarkable photosensitive
properties has stimulated the research on more advanced solar‐blind photodetector (SBPD) …

Unveiling the Structural Descriptor of A3B2X9 Perovskite Derivatives toward X‐Ray Detectors with Low Detection Limit and High Stability

M Xia, JH Yuan, G Niu, X Du, L Yin… - Advanced Functional …, 2020 - Wiley Online Library
Metal halide perovskites and derivatives exhibit a high sensitivity and low detection limit as
direct X‐ray detectors. Inorganic 2D bismuth halide perovskites are promising for X‐ray …

All-inorganic copper halide as a stable and self-absorption-free X-ray scintillator

X Zhao, G Niu, J Zhu, B Yang, JH Yuan… - The journal of …, 2020 - ACS Publications
Lead halide perovskites have recently shown great potential as X-ray scintillators; however,
the toxicity of the lead element seriously restricts their applications. Herein we report a new …

One-Dimensional All-Inorganic K2CuBr3 with Violet Emission as Efficient X-ray Scintillators

W Gao, G Niu, L Yin, B Yang, JH Yuan… - ACS Applied …, 2020 - ACS Publications
Lead halide perovskites have shown great X-ray scintillation properties. One big challenge
is to find nontoxic replacements for practical applications. Moreover, the scintillator should …

GGA-1/2 self-energy correction for accurate band structure calculations: the case of resistive switching oxides

JH Yuan, Q Chen, LRC Fonseca, M Xu… - Journal of Physics …, 2018 - iopscience.iop.org
First-principles calculation has become an indispensable methodology in revealing the
working principles of nanoscale electronic devices, but ultra-large supercells are usually …