Xi Xu

ORCID

Publication Activity (10 Years)

Years Active: 2019-2024
Publications (10 Years): 8

Top Venues

Inorganic chemistry

The Journal of chemical physics

RSC advances

Journal of the American Chemical Society

University of Wisconsin Madison

Peking University (PHD)

This page only lists publications with an associated author ORCID identifier.

Affiliation History

University of Wisconsin Madison

United States

Postdoc :: Department of Chemistry

Education History

Peking University

China

PHD :: Chemistry

Nankai University

China

BSC :: Chemistry

Publications

Jingyu Guo, Xiangtong Zhan, Jiating Lan, Xin Liu, Shuang Zhao, Xi Xu, Li-Ming Wu, Ling Chen
Sb 4 O 5 I 2 : Enhancing Birefringence through Optimization of Sb/I Ratio for Alignment of Stereochemically Active Lone Pairs. Inorganic chemistry (2024)
Jingyu Guo, Xiangtong Zhan, Jiating Lan, Xin Liu, Shuang Zhao, Xi Xu, Li-Ming Wu, Ling Chen
Sb 4 O 5 I 2 : Enhancing Birefringence through Optimization of Sb/I Ratio for Alignment of Stereochemically Active Lone Pairs. Inorganic chemistry 63 (4) (2024)
Xi Xu
Constrained Nuclear-Electronic Orbital Density Functional Theory with a Dielectric Continuum Solvent Model. The journal of physical chemistry. A (2023)
Yuzhe Zhang, Xi Xu, Nan Yang, Zehua Chen, Yang Yang
Describing proton transfer modes in shared proton systems with constrained nuclear-electronic orbital methods. The Journal of chemical physics 158 (23) (2023)
Yuzhe Zhang, Yiwen Wang, Xi Xu, Zehua Chen, Yang Yang
Vibrational Spectra of Highly Anharmonic Water Clusters: Molecular Dynamics and Harmonic Analysis Revisited with Constrained Nuclear-Electronic Orbital Methods. Journal of chemical theory and computation (2023)
Xi Xu, Zehua Chen, Yang Yang
Molecular Dynamics with Constrained Nuclear Electronic Orbital Density Functional Theory: Accurate Vibrational Spectra from Efficient Incorporation of Nuclear Quantum Effects. Journal of the American Chemical Society 144 (9) (2022)
Xi Xu, Hong Jiang
Anion order in perovskite oxynitrides AMO 2 N (A = Ba, Sr, Ca; M = Ta, Nb): a first-principles based investigation. RSC advances 10 (41) (2020)
Xi Xu, Hong Jiang
Cluster expansion based configurational averaging approach to bandgaps of semiconductor alloys. The Journal of chemical physics 150 (3) (2019)

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Publication Activity (10 Years)

Top Topics

Top Venues

Xi Xu