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Theoretical and Computational Chemistry

Working Paper

Vibrational spectra of highly anharmonic water clusters: Molecular dynamics and harmonic analyses revisited with constrained nuclear-electronic orbital methods

Yuzhe Zhang, Yiwen Wang, Xi Xu, Zehua Chen, Yang Yang

Version 3 posted 15 November 2023

420

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Materials Chemistry

Working Paper

Water as a modifier in a hybrid coordination network glass

Søren Strandskov Sørensen, Xiangting Ren, Tao Du, Ayoub Traverson, Shibo Xi, Lars R. Jensen, Mathieu Bauchy, Satoshi Horike, John Wang, Morten M. Smedskjaer

Version 1 posted 21 September 2022

188

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Theoretical and Computational Chemistry

Working Paper

An invertible, invariant crystallographic representation for inverse design of solid-state materials using generative deep learning

Hang Xiao, Rong Li, Xiaoyang Shi, Yan Chen, Liangliang Zhu, Lei Wang, Xi Chen

Version 1 posted 22 May 2023

546

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Physical Chemistry

Working Paper

Silver cation-mediated dual-emissive Au–Ag bimetallic nanoclusters for pH ratiometric sensing

Po Peng, Liu-Xi Zheng, Pan-Yue Wang, Jia-Feng Zhou, Meng Ding, Hao-Di Sun, Bing-Qian Shan, kun zhang

Version 1 posted 22 July 2021

125

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Biological and Medicinal Chemistry

Working Paper

SARS-CoV-2 and MERS-CoV spike protein binding studies support stable mimic of bound 9-O-acetylated sialic acids

Lisa Oh, Ajit Varki, Xi Chen, Lee-Ping Wang

Version 1 posted 20 July 2022

164

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1

Citations

Organic Chemistry

Working Paper

Template Synthesis to Solve the Unreachable Ortho C-H Func-tionalization Reaction of Iodobenzene

Bo-Sheng Zhang, Wan-Yuan Jia, Yi-Ming Wang, Svenja Warratz, Ze-Qiang Zhang, Xue-Ya Gou, Yong-Min Liang, Xi-Cun Wang, Zheng-Jun Quan, Lutz Ackermann

Version 1 posted 08 May 2023

774

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1

Citations

Energy

Working Paper

Maximization of Hydrogen Peroxide Utilization in PEM H2O2 Electrolyzer for Efficient Power-to-Hydrogen Conversion

Jie Yang, Ruimin Ding, Chang Liu, Lifang Chen, Qi Wang, Shanshan Liu, Qinchao Xu, Xi Yin

Version 1 posted 09 March 2023

160

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Materials Science

Working Paper

Making the Best Use of Excited-State Energy: Multimodality Theranostic Systems Based on NIR-II AIEgens

Wenhan XU, Zhijun Zhang, Miaomiao Kang, Heng Guo, Youmei Li, Haifei Wen, Michelle Mei Suet Lee, Zhaoyu Wang, Jacky W. Y. Lam, Ryan Tsz Kin Kwok, Kai Li, Lei Xi, Sijie Chen, Dong Wang, Ben Zhong Tang

Version 1 posted 19 June 2020

579

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Analytical Chemistry

Working Paper

Improved Annotation of Untargeted Metabolomics Data Through Buffer Modifications That Shift Adduct Mass and Intensity

Wenyun Lu, Xi Xing, Lin Wang, Li Chen, Sisi Zhang, Melanie McReynolds, Joshua D Rabinowitz

Version 2 posted 22 June 2020

933

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Organic Chemistry

Working Paper

Nickel-Catalyzed Three-Component Olefin Reductive Dicarbofunctionalization to Access Highly Functionalized Alkylborates

Xiao-Xu Wang, Xi Lu, Shi-Jiang He, Yao Fu

Version 1 posted 07 February 2020

816

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Refine Search

32 results in Xi Wang in Authors: Xi Wang

Vibrational spectra of highly anharmonic water clusters: Molecular dynamics and harmonic analyses revisited with constrained nuclear-electronic orbital methods

Water as a modifier in a hybrid coordination network glass

An invertible, invariant crystallographic representation for inverse design of solid-state materials using generative deep learning

Silver cation-mediated dual-emissive Au–Ag bimetallic nanoclusters for pH ratiometric sensing

SARS-CoV-2 and MERS-CoV spike protein binding studies support stable mimic of bound 9-O-acetylated sialic acids

Template Synthesis to Solve the Unreachable Ortho C-H Func-tionalization Reaction of Iodobenzene

Maximization of Hydrogen Peroxide Utilization in PEM H2O2 Electrolyzer for Efficient Power-to-Hydrogen Conversion

Making the Best Use of Excited-State Energy: Multimodality Theranostic Systems Based on NIR-II AIEgens

Improved Annotation of Untargeted Metabolomics Data Through Buffer Modifications That Shift Adduct Mass and Intensity

Nickel-Catalyzed Three-Component Olefin Reductive Dicarbofunctionalization to Access Highly Functionalized Alkylborates

32 results in Authors: Xi Wang