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Theoretical and Computational Chemistry

Working Paper

Plasmon Character Index: An Accurate and Efficient Metric for Identifying and Quantifying Plasmons in Molecules

James Langford, Xi Xu, Yang Yang

198

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Organic Chemistry

Working Paper

New Application of Natural Language Processing（NLP）for Chemist Predicting Intermediate and Providing an Effective Direction for Mechanism Inference

Jiangcheng Xu, Yun Zhang, Jiale Han, Haoran Qiao, Chengyun zhang, Jing Tang, Shen Xi, Bin Sun, Silong Zhai, Xinqiao Wang, Yejian Wu, Weike Su, Hongliang Duan

306

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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

538

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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

71

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Physical Chemistry

Working Paper

Relaxed structure of typical nitro explosives in the excited state: observation, implication and application

Genbai Chu, Zuhua Yang, Tao Xi, Jianting Xin, Yongqiang Zhao, Weihua He, Min Shui, Yuqiu Gu, Ying Xiong, Tao Xu

847

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Materials Science

Working Paper

Microporous covalent organic frameworks for sulfur hexafluoride capture and separation

Qiaobo Liao, Haocheng Xu, Can Ke, Yiying Zhang, Qingwen Han, Yifan Zhang, Yang Xu, Kai Xi

207

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Materials Science

Working Paper

Conductive SWCNT/PDMS bottlebrush elastomers for ultrasoft electronics

Pengfei Xu, Shaojia Wang, Angela Lin, Hyun-Kee Min, Zhanfeng Zhou, Xi Huang, Helen Tran, Xinyu Liu

456

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1

Citations

Theoretical and Computational Chemistry

Working Paper

Molecular dynamics with constrained nuclear electronic orbital density functional theory: Accurate vibrational spectra from efficient incorporation of nuclear quantum effects

Xi Xu, Zehua Chen, Yang Yang

162

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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

787

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Catalysis

Working Paper

Zero-valent Palladium Single-Atoms Catalysts Confined in Black Phosphorus for Efficient Semi-hydrogenation

cheng chen, Ou Wei, Yam Kahmeng, Xi Shibo, Zhao Xiaoxu, Chen Si, Jing Li, Lvy Pin, Ma Lu, Xu Haomin, Yu Wei, Fang Hanyan, Yao Chuanhao, Hai Xiao, Ming Joo Koh, Lin Ming, Stephen J. Pennycook, Lu Junling, Du Yonghua, Su Chenliang, Zhang Chun, Jiong Lu

541

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Refine Search

16 results in Xi Xu in Authors: Xi Xu

Plasmon Character Index: An Accurate and Efficient Metric for Identifying and Quantifying Plasmons in Molecules

New Application of Natural Language Processing（NLP）for Chemist Predicting Intermediate and Providing an Effective Direction for Mechanism Inference

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

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

Relaxed structure of typical nitro explosives in the excited state: observation, implication and application

Microporous covalent organic frameworks for sulfur hexafluoride capture and separation

Conductive SWCNT/PDMS bottlebrush elastomers for ultrasoft electronics

Molecular dynamics with constrained nuclear electronic orbital density functional theory: Accurate vibrational spectra from efficient incorporation of nuclear quantum effects

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

Zero-valent Palladium Single-Atoms Catalysts Confined in Black Phosphorus for Efficient Semi-hydrogenation

16 results in Authors: Xi Xu