TUMME: Tsinghua University Minnesota Master Equation program
Zhang, Rui Ming, Xu, Xuefei, Truhlar, Donald G.
Published in Computer physics communications (31.08.2021)
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Published in Computer physics communications (31.08.2021)
Journal Article
Facile fabrication of TiO2/Bi5O7Br photocatalysts for visible-light-assisted removal of tetracycline and dye wastewaters
Salmanzadeh-Jamadi, Zahra, Habibi-Yangjeh, Aziz, Pouran, Shima Rahim, Xu, Xuefei, Wang, Chundong
Published in Journal of physics. D, Applied physics (21.04.2022)
Published in Journal of physics. D, Applied physics (21.04.2022)
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Direct Nonadiabatic Dynamics of Ammonia with Curvature-Driven Coherent Switching with Decay of Mixing and with Fewest Switches with Time Uncertainty: An Illustration of Population Leaking in Trajectory Surface Hopping Due to Frustrated Hops
Zhao, Xiaorui, Shu, Yinan, Zhang, Linyao, Xu, Xuefei, Truhlar, Donald G.
Published in Journal of chemical theory and computation (28.03.2023)
Published in Journal of chemical theory and computation (28.03.2023)
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Identification of Torsional Modes in Complex Molecules Using Redundant Internal Coordinates: The Multistructural Method with Torsional Anharmonicity with a Coupled Torsional Potential and Delocalized Torsions
Chen, Wenqi, Zhang, Pengchao, Truhlar, Donald G., Zheng, Jingjing, Xu, Xuefei
Published in Journal of chemical theory and computation (13.12.2022)
Published in Journal of chemical theory and computation (13.12.2022)
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Journal Article
Comprehensive Theoretical Study on Four Typical Intramolecular Hydrogen Shift Reactions of Peroxy Radicals: Multireference Character, Recommended Model Chemistry, and Kinetics
Li, Yan, Wang, Ying, Zhang, Rui Ming, He, Xiao, Xu, Xuefei
Published in Journal of chemical theory and computation (13.06.2023)
Published in Journal of chemical theory and computation (13.06.2023)
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Journal Article
Irisin protects mitochondria function during pulmonary ischemia/reperfusion injury
Chen, Ken, Xu, Zaicheng, Liu, Yukai, Wang, Zhen, Li, Yu, Xu, Xuefei, Chen, Caiyu, Xia, Tianyang, Liao, Qiao, Yao, Yonggang, Zeng, Cindy, He, Duofen, Yang, Yongjian, Tan, Tao, Yi, Jianxun, Zhou, Jingsong, Zhu, Hua, Ma, Jianjie, Zeng, Chunyu
Published in Science translational medicine (29.11.2017)
Published in Science translational medicine (29.11.2017)
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Journal Article
Fragmentation modeling of gas-phase ionic liquid clusters in high-voltage electric field
Su, Lipeng, Zhuo, Jiankun, Liu, Hao, Yao, Zhaopu, Xu, Xuefei, Li, Shuiqing
Published in Fuel (Guildford) (01.03.2023)
Published in Fuel (Guildford) (01.03.2023)
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Journal Article
Master equation study of hydrogen abstraction from HCHO by OH via a chemically activated intermediate
Zhang, Rui Ming, Chen, Wenqi, Truhlar, Donald G., Xu, Xuefei
Published in Faraday discussions (08.02.2022)
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Published in Faraday discussions (08.02.2022)
Journal Article
Benchmark Calculations for Bond Dissociation Enthalpies of Unsaturated Methyl Esters and the Bond Dissociation Enthalpies of Methyl Linolenate
Li, Xiaoyu, Xu, Xuefei, You, Xiaoqing, Truhlar, Donald G
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (16.06.2016)
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (16.06.2016)
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Journal Article
Novel hierarchical CuNiAl LDH nanotubes with excellent peroxidase-like activity for wide-range detection of glucose
Wu, Lihong, Zhou, Xuechun, Wan, Gengping, Tang, Yulin, Shi, Shaohua, Xu, Xuefei, Wang, Guizhen
Published in Dalton transactions : an international journal of inorganic chemistry (07.01.2021)
Published in Dalton transactions : an international journal of inorganic chemistry (07.01.2021)
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Journal Article
Observing Intramolecular Vibrational Energy Redistribution via the Short-Time Fourier Transform
Zhang, Rui Ming, Xu, Xuefei, Truhlar, Donald G.
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (19.05.2022)
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (19.05.2022)
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Journal Article
N -Doping of Graphene Aerogel as a Multifunctional Air Cathode for Microbial Fuel Cells
Wang, Guowen, Xu, Xuefei, Kou, Xiaonan, Liu, Xing, Dong, Xiaoli, Ma, Hongchao, Wang, Dong
Published in ACS applied materials & interfaces (03.11.2021)
Published in ACS applied materials & interfaces (03.11.2021)
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Journal Article
How sodium chloride extends lifetime of bulk nanobubbles in water
Feng, Muye, Ma, Xiaotong, Zhang, Zeyun, Luo, Kai H, Sun, Chao, Xu, Xuefei
Published in Soft matter (13.04.2022)
Published in Soft matter (13.04.2022)
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Journal Article
Pressure-dependent kinetics of the o -xylene reaction with OH radicals
Li, Yan, Guo, Xuan, Zhang, Rui Ming, Zhang, Hui, Zhang, Xin, Xu, Xuefei
Published in Physical chemistry chemical physics : PCCP (13.04.2022)
Published in Physical chemistry chemical physics : PCCP (13.04.2022)
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Journal Article
Visible-light-triggered persulfate activation by CuCo2S4 modified ZnO photocatalyst for degradation of tetracycline hydrochloride
Habibi, Meysam, Habibi-Yangjeh, Aziz, Pouran, Shima Rahim, Chand, Hushan, Krishnan, Venkata, Xu, Xuefei, Wang, Chundong
Published in Colloids and surfaces. A, Physicochemical and engineering aspects (05.06.2022)
Published in Colloids and surfaces. A, Physicochemical and engineering aspects (05.06.2022)
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Crystalline/amorphous heterostructure offering highly efficient overall water splitting and urea electrolysis
Qin, Mingliang, Li, Yadong, Zhang, Huaming, Humayun, Muhammad, Xu, Xuefei, Fu, Yanjun, Kadirov, Marsil K., Wang, Chundong
Published in Journal of alloys and compounds (15.11.2022)
Published in Journal of alloys and compounds (15.11.2022)
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Journal Article
Spectroscopy of triatomic [Si, P, O] molecules
Chen, Wenqi, Trabelsi, Tarek, Xu, Xuefei, Franciso, Joseph S.
Published in Molecular physics (17.04.2024)
Published in Molecular physics (17.04.2024)
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Journal Article
Core-shell structured Co(OH)F@FeOOH enables highly efficient overall water splitting in alkaline electrolyte
Li, Rong, Wang, Yamei, Chen, Baojin, Zhang, Huaming, Yan, Chao, Xu, Xuefei, Humayun, Muhammad, Debecker, Damien P., Wang, Chundong
Published in International journal of hydrogen energy (02.01.2024)
Published in International journal of hydrogen energy (02.01.2024)
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