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Gu Jingwang Xiao Zengjun Yu Chunting Zhang Qiang Chen Yang Zhao Dongfeng（Department of Chemical Physics， University of Science and Technology of China， Hefei National Laboratory for Physical Sciences at the Microscale， Hefei， 230026）.MgF自由基A~2∏-X~2Σ~+跃迁的高分辨激光诱导荧光光谱和Franck-Condon因子[J].Chinese Journal of Chemical Physics,2022,第1期
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Feng An，Shanyu Han，Xixi Hu，Kaijun Yuan，Daiqian Xie（Institute of Theoretical and Computational Chemistry，Key Laboratory of Mesoscopic Chemistry，School of Chemistry and Chemical Engineering，Nanjing University，Nanjing 210023，China；Department of Chemistry and Chemical Biology，University of New Mexico，New Mexico 87131，USA；Kuang Yarning Honors School，Institute for Brain Sciences，Nanjing University，Nanjing 210023，China；State key Laboratory of Molecular Reaction Dynamics，Dalian Institute of Chemical Physics，Chinese Academy of Sciences，Dalian 116023，China）.Adiabatic Potential Energy Surfaces and Photodissociation Mechanisms for Highly Excited States of H2O[J].化学物理学报(英文版),2022,第1期
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Ya-Jie Guo，Ya-Jun Liu（Key Laboratory of Theoretical and Computational Photochemistry，Ministry of Education，College of Chemistry，Beijing Normal University，Beijing 100875，China；Key Laboratory of Theoretical and Computational Photochemistry，Ministry of Education，College of Chemistry，Beijing Normal University，Beijing 100875，China；Center for Advanced Materials Research，Advanced Institute of Natural Sciences，Beijing Normal University at Zhuhai，Zhuhai 519087，China）.QM/MM Study on Enzymatic Mechanism in Sinigrin Biosynthesis[J].化学物理学报(英文版),2022,第1期
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Chengzhen Shen，Jie Peng，Jianxin Guan，Chuangqing Hao，Zhihao Yu，Hong Jiang，Junrong Zheng（College of Chemistry and Molecular Engineering，Beijing National Laboratory for Molecular Sciences，Peking University，Beijing 100871，China）.Relative Molecular Orientations in Organic Optoelectronic Films Probed via Polarization-Selected UV/IR Mixed Frequency Ultrafast Spectroscopy[J].化学物理学报(英文版),2022,第1期
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Wen-Kai Chen，Ganglong Cui，Xiang-Yang Liu（Key Laboratory of Theoretical and Computational Photochemistry，Ministry of Education，College of Chemistry，Beijing Normal University，Beijing 100875，China；College of Chemistry and Material Science，Sichuan Normal University，Chengdu 610068，China）.Solvent Effects on Excited-State Relaxation Dynamics of Paddle-Wheel BODIPY-Hexaoxatriphenylene Conjugates：Insights from Non-adiabatic Dynamics Simulations[J].化学物理学报(英文版),2022,第1期
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Wei Zhang，Jie Kong，Wenqi Xu，Xinmiao Niu，Di Song，Weimin Liu，Andong Xia（State Key Laboratory of Information Photonic and Optical Communications，School of Science，Beijing University of Posts and Telecommunications(BUPT)，Beijing 100876，China；Beijing National Laboratory for Molecular Sciences(BNLMS)，Key Laboratory of Photochemistry，Institute of Chemistry，Chinese Academy of Sciences，Beijing 100190，China；Department of Chemical Physics，University of Science and Technology of China，Hefei 230026，China；School of Physical Science and Technology，ShanghaiTech University，Shanghai 201210，China；STU SIOM Joint Laboratory for Superintense Lasers and the Applications，Shanghai 201210，China；Beijing National Laboratory for Molecular Sciences(BNLMS)，Key Laboratory of Photochemistry，Institute of Chemistry，Chinese Academy of Sciences，Beijing 100190，China；State Key Laboratory of Information Photonic and Optical Communications，School of Science，Beijing University of Posts and Telecommunications(BUPT)，Beijing 100876，China）.Probing Effect of Solvation on Photoexcited Quadrupolar Donor-Acceptor-Donor Molecule via Ultrafast Raman Spectroscopy[J].化学物理学报(英文版),2022,第1期
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Haipan Xiang，Yunpeng Lu，Hongwei Song，Minghui Yang（State Key Laboratory of Magnetic Resonance and Atomic and Molecular Physics，Innovation Academy for Precision Measurement Science and Technology，Chinese Academy of Sciences，Wuhan 430071，China；College of Physical Science and Technology，Huazhong Normal University，Wuhan 430079，China；Division of Chemistry and Biological Chemistry，School of Physical and Mathematical Sciences，Nanyang Technological University，Singapore 637371，Singapore；State Key Laboratory of Magnetic Resonance and Atomic and Molecular Physics，Innovation Academy for Precision Measurement Science and Technology，Chinese Academy of Sciences，Wuhan 430071，China；State Key Laboratory of Magnetic Resonance and Atomic and Molecular Physics，Innovation Academy for Precision Measurement Science and Technology，Chinese Academy of Sciences，Wuhan 430071，China；Wuhan National Laboratory for Optoelectronics，Huazhong University of Science and Technology，Wuhan 430071，China）.Mode-Specific Quantum Dynamics Study of OH+H2S-H2O+SH Reaction[J].化学物理学报(英文版),2022,第1期
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Meng Zhang，Yongfa Zhu，Jun Li（School of Chemistry and Chemical Engineering&Chongqing Key Laboratory of Theoretical and Computational Chemistry，Chongqing University，Chongqing 401331，China；School of Chemistry and Chemical Engineering，Hubei Polytechnic University，Huangshi 435003，China）.Product Vibrational State Distributions of F+CH3OH Reaction on Full-Dimensional Accurate Potential Energy Surface[J].化学物理学报(英文版),2022,第1期
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Yuli Lei，Haibo Ma，Luis Vasquez（School of Chemistry and Chemical Engineering，Nanjing University，Nanjing 210023，China）.Ab Initio Nonadiabatic Dynamics of Semiconductor Materials via Surface Hopping Method[J].化学物理学报(英文版),2022,第1期
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Zi-Yu Li，Li-Hui Mou，Gui-Duo Jiang，Qing-Yu Liu，Sheng-Gui He（State Key Laboratory for Structural Chemistry of Unstable and Stable Species，Institute of Chemistry，Chinese Academy of Sciences，Beijing 100190，China；Beijing National Laboratory for Molecular Sciences and CAS Research/Education Center of Excellence in Molecular Sciences，Beijing 100190，China；State Key Laboratory for Structural Chemistry of Unstable and Stable Species，Institute of Chemistry，Chinese Academy of Sciences，Beijing 100190，China；University of Chinese Academy of Sciences，Beijing 100049，China；Beijing National Laboratory for Molecular Sciences and CAS Research/Education Center of Excellence in Molecular Sciences，Beijing 100190，China）.15N/14N Isotopic Exchange in the Dissociative Adsorption of N2 on Tantalum Nitride Cluster Anions Ta3N3-[J].化学物理学报(英文版),2022,第1期
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Mingjuan Yang，Tong Cheng，Rui Zheng，Hongwei Song，Minghui Yang（Key Laboratory of Magnetic Resonance in Biological Systems，State Key Laboratory of Magnetic Resonance and Atomic and Molecular Physics，National Center for Magnetic Resonance in Wuhan，Wuhan Institute of Physics and Mathematics，Innovation Academy for Precision Measurement Science and Technology，Chinese Academy of Sciences，Wuhan 430071，China；University of Chinese Academy of Sciences，Beijing 100049，China；School of Mathematics and Information Science，North China University of Water Resources and Electric Power，Zhengzhou 450011，China；Key Laboratory of Magnetic Resonance in Biological Systems，State Key Laboratory of Magnetic Resonance and Atomic and Molecular Physics，National Center for Magnetic Resonance in Wuhan，Wuhan Institute of Physics and Mathematics，Innovation Academy for Precision Measurement Science and Technology，Chinese Academy of Sciences，Wuhan 430071，China；Key Laboratory of Magnetic Resonance in Biological Systems，State Key Laboratory of Magnetic Resonance and Atomic and Molecular Physics，National Center for Magnetic Resonance in Wuhan，Wuhan Institute of Physics and Mathematics，Innovation Academy for Precision Measurement Science and Technology，Chinese Academy of Sciences，Wuhan 430071，China；University of Chinese Academy of Sciences，Beijing 100049，China；Wuhan National Laboratory for Optoelectronics，Huazhong University of Science and Technology，Wuhan 430071，China）.Ten-Dimensional Quantum Dynamics Study of H+CH3D→H2+CH2D Reaction[J].化学物理学报(英文版),2022,第1期
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Tonghui Yin，Liying Ma，Hong Gao，Min Cheng（Beijing National Laboratory for Molecular Sciences；Institute of Chemistry，Chinese Academy of Sciences，Beijing 100190，China；University of Chinese Academy of Sciences，Beijing 100049，China）.Systematical Study on Photodissociation Dynamics of BrCN from 225 nm to 260 nm[J].化学物理学报(英文版),2022,第1期
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Jiaying Chen，Tongmei Ma，Shuming Bai，Qiang Shi（School of Chemistry and Chemical Engineering，South China University of Technology，Guangzhou 510641，China；Beijing National Laboratory for Molecular Sciences，State Key Laboratory for Structural Chemistry of Unstable and Stable Species，Institute of Chemistry，Chinese Academy of Sciences，Beijing 100190，China；School of Chemistry and Chemical Engineering，South China University of Technology，Guangzhou 510641，China；Beijing National Laboratory for Molecular Sciences，State Key Laboratory for Structural Chemistry of Unstable and Stable Species，Institute of Chemistry，Chinese Academy of Sciences，Beijing 100190，China；Beijing National Laboratory for Molecular Sciences，State Key Laboratory for Structural Chemistry of Unstable and Stable Species，Institute of Chemistry，Chinese Academy of Sciences，Beijing 100190，China；University of Chinese Academy of Sciences，Beijing 100049，China；Physical Science Laboratory，Huairou National Comprehensive Science Center，Beijing 101407，China）.Electronic Couplings for Singlet Oxygen Photosensitization and Its Molecular Orbital Overlap Description[J].化学物理学报(英文版),2022,第1期
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Jingwang Gu，Zengjun Xiao，Chunting Yu，Qiang Zhang，Yang Chen，Dongfeng Zhao（Hefei National Laboratory for Physical Sciences at the Microscale，Department of Chemical Physics，University of Science and Technology of China，Hefei 230026，China.）.High Resolution Laser Excitation Spectra and Franck-Condon Factors of A2Π-X2Σ+Electronic Transition of MgF[J].化学物理学报(英文版),2022,第1期
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Peng Wang，Shuai-Ting Yan，Hong-Guang Xu，Xi-Ling Xu，Wei-Jun Zheng（Beijing National Laboratory for Molecular Sciences，State Key Laboratory of Molecular Reaction Dynamics，Institute of Chemistry，Chinese Academy of Sciences，Beijing 100190，China；University of Chinese Academy of Sciences，Beijing 100049，China）.Anion Photoelectron Spectroscopy and Density Functional Theory Studies of AuCn-/0(n=3-8)：Odd-Even Alternation in Electron Binding Energies and Structures[J].化学物理学报(英文版),2022,第1期
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Editorial Board of Chinese Journal of Chemical Physics.A Tribute to Professor Nanquan Lou[J].化学物理学报(英文版),2022,第1期
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Xiongzhi Zeng，Wei Hu，Xiao Zheng，Jin Zhao，Zhenyu Li，Jinlong Yang（Hefei National Laboratory for Physical Sciences at the Microscale，University of Science and Technology of China，Hefei 230026，China）.Computational Characterization of Nanosystems[J].化学物理学报(英文版),2022,第1期
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Zhimo Wang，Changjian Xie（Institute of Modern Physics，Shaanxi Key Laboratory for Theoretical Physics Frontiers，Northwest Uni-versity，Xi'an 710127，China）.Kinetics and Dynamics of the H(2S)+NO(X2Π)→N(4S)+OH(X2Π)Reaction：A Quasi-classical Trajectory Studyt[J].化学物理学报(英文版),2022,第1期
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Liang Zhang，Lingjun Zhu，Bin Jiang（Department of Chemical Physics，Key Laboratory of Surface and Interface Chemistry and Energy Catal-ysis of Anhui Higher Education Institutes，University of Science and Technology of China，Hefei 230026，China）.Six-Dimensional State-to-State Quantum Dynamics of H2/D2 Scattering from Cu(100)：Validity of Site-Averaging Model[J].化学物理学报(英文版),2022,第1期
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Yu Zhai，Hui Li（Institute of Theoretical Chemistry，College of Chemistry，Jilin University，Changchun 130023，China）.Basis Sets Dependency in Constructing Spectroscopy-Accuracy Ab Initio Global Electric Dipole Moment Functions[J].化学物理学报(英文版),2022,第1期
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Junfang Yang，Qian Peng（School of Chemical Sciences，University of Chinese Academy of Sciences，Beijing 100049，China）.Effects of Intermolecular Interactions on Luminescence Property in Organic Molecules[J].化学物理学报(英文版),2022,第1期
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Aoran Sun，Jianping Wang（Beijing National Laboratory for Molecular Sciences，Molecular Reaction Dynamics Laboratory，Institute of Chemistry，Chinese Academy of Sciences，Beijing 100190，China；University of Chinese Academy of Sciences，Beijing 100049，China；CAS Key Laboratory of Soft Matter Physics，Institute of Physics，Chinese Academy of Sciences，Beijing 100190，China；Beijing National Laboratory for Molecular Sciences，Molecular Reaction Dynamics Laboratory，Institute of Chemistry，Chinese Academy of Sciences，Beijing 100190，China；University of Chinese Academy of Sciences，Beijing 100049，China）.Limits in Enhancement Factor in Near-Brewster Angle Reflection Pump-Probe Two-Dimensional Infrared Spectroscopy[J].化学物理学报(英文版),2022,第1期
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Lei Zhang，Zheng Cheng，Wei Li，Shuhua Li（Key Laboratory of Mesoscopic Chemistry of Ministry of Education，Institute of Theoretical and Compu-tational Chemistry，School of Chemistry and Chemical Engineering，Nanjing University，Nanjing 210023，China）.Generalized Energy-Based Fragmentation Approach for Accurate Binding Energies and Raman Spectra of Methane Hydrate Clusters[J].化学物理学报(英文版),2022,第1期
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Jia Luo，Jianwei Cao，Hao Liu，Wensheng Bian（Beijing National Laboratory for Molecular Sciences，Institute of Chemistry，Chinese Academy of Sciences，Beijing 100190，China；School of Chemical Sciences，University of Chinese Academy of Sciences，Beijing 100049，China；Beijing National Laboratory for Molecular Sciences，Institute of Chemistry，Chinese Academy of Sciences，Beijing 100190，China）.Accurate Quantum Dynamics of the Simplest Isomerization System Involving Double-H Transfer[J].化学物理学报(英文版),2022,第1期
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沈成桢，彭洁，关键鑫，郝传清，于志浩，蒋鸿，郑俊荣（北京大学化学与分子工程学院，北京分子科学国家研究中心）.通过具有偏振选择性的紫外/红外混频超快光谱探测有机光电薄膜中的相对分子取向[J].Chinese Journal of Chemical Physics,2022,第1期
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