期刊的影响因子--文章列表

期刊文章列表
Peter M. Felker，ZlatkoBaˇci´c（Department of Chemistry and Biochemistry University of California Los Angeles CA 90095-1569USA；Department of Chemistry New York University New York 10003 USA；NYU-ECNU Center for Computational Chemistry at NYU Shanghai；Accepted on October31 2021）.Intra- and Intermolecular Rovibrational States of HCl-H₂O and DCl-H₂O Dimers from Full-Dimensional and Fully Coupled Quantum Calculations^†[J].化学物理学报(英文版),2021,第6期 Mingsong Shi，Xin Zhou，Yao Cai，Penghui Li，Dengxue Qin，Xinrong Yan，Meng Du，Shuo Li，Dingguo Xu（State Key Laboratory of Biotherapy West China Hospital of Sichuan University Chengdu 610041China；College of Chemistry Sichuan University；Research Center for Material Genome Engineering Sichuan University；Accepted on November10 2021）.Inhibition Mechanism of Hydroxyproline-like Small Inhibitors to Disorder HIF-VHL Interaction by Molecular Dynamic Simulations and Binding Free Energy Calculations^†[J].化学物理学报(英文版),2021,第6期阴化冰^1,2，刘雅茹¹，马玉臣¹（山东大学化学与化工学院；河南大学物理与电子学院计算材料科学研究所河南省新能源材料与器件国际联合实验室）.单壁碳纳米管中暗激子变亮的多体格林函数理论研究[J].化学物理学报(英文版),2021,第6期 Shuwei Jin，Jia-Ning Wang，Yuanfei Xue，Pengfei Li，Ye Mei（State Key Laboratory of Precision Spectroscopy School of Physics and Electronic Science East China Normal University ；NYU-ECNU Center for Computational Chemistry at NYU Shanghai；Collaborative Innovation Center of Extreme Optics Shanxi University；Silicon Therapeutics (Suzhou) Co Ltd；Accepted on November14 2021）.Selectivity of Parvalbumin B Protein Binding to Ca²⁺ and Mg²⁺ at an Ab Initio QM/MM Level Using the Reference-Potential Method^†[J].化学物理学报(英文版),2021,第6期 Chaofan Li，Siting Hou，Changjian Xie（Institute of Modern Physics Northwest University；Shaanxi Key Laboratory for Theoretical Physics Frontiers；Accepted on November8 2021）.Three-Dimensional Diabatic Potential Energy Surfaces of Thiophenol with Neural Networks^†[J].化学物理学报(英文版),2021,第6期 Peijun Xu，Xiaohong Mou，Qiuhan Guo，Ting Fu，Hong Ren，Guiyan Wang，Yan Li，Guohui Li（Liaoning Normal University；Pharmacy Department of Affiliated Zhongshan Hospital of Dalian University；Department of Ophthalmology Aerospace Center Hospital；Dalian Ocean University；Dalian Institute of Chemical Physics State Key Laboratory of Molecular Reaction Dynamics Daliane Dalian Institute of Chemical Physics State Key Laboratory of Molecular Reaction Dynamics；Accepted on December13 2021）.Coarse-Grained Molecular Dynamics Study based on TorchMD^†[J].化学物理学报(英文版),2021,第6期刘云昊，王可，马海波（南京大学化学化工学院江苏省机动车尾气污染控制重点实验室）.利用重正化激子方法计算离域离子态或激发态的一阶分子性质[J].化学物理学报(英文版),2021,第6期 Shang Chenyao，Chen Jun，Xu Xin，Liu Shu，Zhang Dong H.State-to-State Quantum Dynamical Study of H+Br_2HBr+Br Reactiony[J].化学物理学报,2021,第6期 Guo-dong Wang，Zhi-xing Liu，Bei-bei Qiu，Zhi-guo Zhang，Rui Wang，Xiao-yong Wang，Jing Ma，Yong-fang Li，Min Xiao，Chun-feng Zhang（National Laboratory of Solid State Microstructures School of Physics and Collaborative Innovationa National Laboratory of Solid State Microstructures School of Physics and Collaborative Innovation；Center for Advanced Microstructures Nanjing University ；Beijing National Laboratory for Molecular Sciences CAS Key Laboratory of Organic Solids Instituteb Beijing National Laboratory for Molecular Sciences CAS Key Laboratory of Organic Solids Institute；of Chemistry Chinese Academy of Sciences；State key Laboratory of Chemical Resource Engineering College of Materials Science and Engineeringc State key Laboratory of Chemical Resource EngineeringCollege of Materials Science and Engineering；Beijing University of Chemical Technology Beijing 100029 China；Institute of Theoretical and Computational Chemistry Key Laboratory of Mesoscopic Chemistry of Ministry of Education School of Chemistry and Chemical Engineering Nanjing University；Department of Physics University of Arkansas Fayetteville Arkansas 72701 USA；Accepted on October12 2021）.Ultrafast Electron Transfer in All-Small-Molecule Photovoltaic Blends Promoted by Intermolecular Interactions in Cyanided Donors^†[J].化学物理学报(英文版),2021,第6期 Jun-fan Xia，Yao-long Zhang，Bin Jiang（Hefei National Laboratory for Physical Science at the Microscale, Department of Chemical Physics,Key Laboratory of Surface and Interface Chemistry and Energy Catalysis of Anhui Higher Education Institutes, University of Science and Technology of China；Accepted on October15）.Efficient Selection of Linearly Independent Atomic Features for Accurate Machine Learning Potentials^†[J].化学物理学报(英文版),2021,第6期 Wei Yan，Yong-fa Zhu，Wei-yu Xie，Hong-wei Song，Chao-yang Zhang，Ming-hui Yang（State Key Laboratory of Magnetic Resonance and Atomic and Molecular Physics Wuhan Institute of Physics and Mathematics Innovation Academy for Precision Measurement Science and Technology Chinese Academy of Sciences；University of Chinese Academy of Sciences；Institute of Chemical Materials China Academy of Engineering Physics；Wuhan National Laboratory for Optoelectronics Huazhong University of Science and Technology；Accepted on October24 2021）.A New Many-Body Expansion Scheme for Atomic Clusters: Application to Nitrogen Clusters^†[J].化学物理学报(英文版),2021,第6期 Chao-jiang Zhang，Shuai-ting Yan，Hong-guang Xu，Xi-ling Xu，Wei-jun Zheng（Beijing National Laboratory for Molecular Sciences (BNLMS) State Key Laboratory of Molecular Reaction Dynamics Institute of Chemistry Chinese Academy of Sciences；University of Chinese Academy of Sciences；Accepted on October31 2021）.Structural and Bonding Properties of Al_nC₄^-/⁰ (n=2-4) Clusters: Anion Photoelectron Spectroscopy and Theoretical Calculations^†[J].化学物理学报(英文版),2021,第6期商辰尧^1,2，陈俊^3,4，徐昕¹，刘舒¹，张东辉¹（中国科学院大连化学物理研究所分子反应动力学国家重点实验室；中国科学院大学；中国科学院福建物质结构研究所结构化学国家重点实验室；中国福建光电信息科学与技术创新实验室）.H+Br₂→HBr+Br反应的态-态量子动力学研究[J].化学物理学报(英文版),2021,第6期 Yan Wei，Zhu Yongfa，Xie Weiyu，Song Hongwei，Zhang Chaoyang，Yang Minghui.A New Many-Body Expansion Scheme for Atomic Clusters:Application to Nitrogen Clustersy[J].化学物理学报,2021,第6期张超江^1,2，闫帅廷^1,2，许洪光^1,2，徐西玲^1,2，郑卫军^1,2（中国科学院化学研究所北京分子科学国家研究中心分子反应动力学实验室；中国科学院大学）.Al_nC₄^-/0（n=2～4）团簇的结构和成键性质：光电子能谱和理论计算[J].化学物理学报(英文版),2021,第6期 Yani Chen，Wanqing Wei，Yanzi Zhou，Daiqian Xie（Institute of Theoretical and Computational Chemistry, Key Laboratory of Mesoscopic Chemistry,School of Chemistry and Chemical Engineering, Nanjing University；Accepted on October31）.The Role of Hydrogen Bond in Catalytic Triad of Serine Proteases^†[J].化学物理学报(英文版),2021,第6期 Jie Qin，Jia Li，JunLi（School of Chemistry and Chemical Engineering & Chongqing Key Laboratory of Theoretical and Computational Chemistry, Chongqing University；Acceptedon August14）.Quasi-Classical Trajectory Investigation of H+SO₂→OH+SO Reaction on Full-Dimensional Accurate Potential Energy Surface^†[J].化学物理学报(英文版),2021,第6期 Jun Huo，Ben-zhuo Lu，Hao Dong（Kuang Yaming Honors School Nanjing University Nanjing 210023 China；CEMSLSECNCMISAcademy of Mathematics and Systems ScienceChinese Academy of Sciencesb CEMSLSECNCMISAcademy of Mathematics and Systems ScienceChinese Academy of Sciences；School of Mathematical Sciences University of Chinese Academy of Sciences；Institute for Brain Sciences Nanjing University ；State Key Laboratory of Analytical Chemistry for Life Science Nanjing University；Engineering Research Center of Protein and Peptide Medicine of Ministry of Education Nanjing University；Accepted on December9 2021）.Mutants only Partially Represent Characteristics of Calcium-Release-Activated Calcium Channel Gating^†[J].化学物理学报(英文版),2021,第6期 Jianwei Cao，Yanan Wu，Wensheng Bian（Beijing National Laboratory for Molecular Sciences Institute of Chemistry Chinese Academy of Sciences；School of Chemical Sciences University of Chinese Academy of Sciences；Accepted on November8 2021）.Ring Polymer Molecular Dynamics of the C(¹D)+H₂ Reaction on the Most Recent Potential Energy Surfaces^†[J].化学物理学报(英文版),2021,第6期 Wen-kai Chen，Xin-wei Sun，Qiu Fang，Xiang-yang Liu，Gang-long Cui（Key Laboratory of Theoretical and Computational Photochemistry Ministry of Education College of Chemistry Beijing Normal University ；College of Chemistry and Material Science Sichuan Normal University；Accepted on October4 2021）.GW/BSE Nonadiabatic Dynamics Simulations on Excited-State Relaxation Processes of Zinc Phthalocyanine-Fullerene Dyads: Roles of Bridging Chemical Bonds^†[J].化学物理学报(英文版),2021,第6期 Qin Jie，Li Jia，Li Jun.Quasi-Classical Trajectory Investigation of H+SO_2OH+SO Reaction on Full-Dimensional Accurate Potential Energy Surfacey[J].化学物理学报,2021,第6期 Sun Zhaoxi，Kalhor Payam，Xu Yang，Liu Jian.Extensive Numerical Tests of Leapfrog Integrator in Middle Thermostat Scheme in Molecular Simulationsy[J].化学物理学报,2021,第6期 Liping Chen，Linjun Wang（Hangzhou Institute of Advanced Studies Zhejiang Normal University；Key Laboratory of Excited-State Materials of Zhejiang Province Zhejiang University；Key Laboratory of Excited-State Materials of Zhejiang Province Department of Chemistry Zhejiang University；Accepted on November12 2021）.Unbiased Fuzzy Global Optimization of Morse Clusters with Short-Range Potential for N≤400^†[J].化学物理学报(英文版),2021,第6期石明松¹，周鑫²，蔡瑶²，李鹏辉²，秦登雪²，严新蓉²，杜孟²，李硕²，徐定国^2,3（四川大学华西医院生物治疗国家重点实验室；四川大学化学学院；四川大学材料基因工程研究中心）.基于分子动力学和自由能计算研究小分子对HIF-VHL相互作用的抑制机理[J].化学物理学报(英文版),2021,第6期 Chen Yani，Wei Wanqing，Zhou Yanzi，Xie Daiqian.The Role of Hydrogen Bond in Catalytic Triad of Serine Proteasesy[J].化学物理学报,2021,第6期 Shi Mingsong，Zhou Xin，Cai Yao，Li Penghui，Qin Dengxue，Yan Xinrong，Du Meng，Li Shuo，Xu Dingguo（West China Hospital of Sichuan University，State Key Laboratory of Biotherapy；College of Chemistry，Sichuan University；Research Center for Material Genome Engineering，Sichuan University）.Inhibition Mechanism of Hydroxyproline-like Small Inhibitors to Disorder HIF-VHL Interaction by Molecular Dynamic Simulations and Binding Free Energy Calculationsy[J].Chinese Journal of Chemical Physics,2021,第6期 Heilong Wang，Yu Li，Zhirun Jiao，Hongtao Zhang，Chunlei Xiao，Xueming Yang（State Key Laboratory of Molecular Reaction DynamicsDalian Institute of Chemical PhysicsChinese Academy of Sciences ；School of Chemical Sciences University of Chinese Academy of Sciences；College of Science Southern University of Science and Technology；Department of Chemical Physics University of Science and Technology of China；Accepted on December6 2021）.Differential Cross Sections of F+HD→DF+H Reaction at Collision Energies from 3.03 meV to 17.97 meV^†[J].化学物理学报(英文版),2021,第6期 Chenyao Shang，Jun Chen，Xin Xu，Shu Liu，Dong H. Zhang（State Key Laboratory of Molecular Reaction Dynamics Dalian Institute of Chemical Physics Chinese Academy of Sciences；University of Chinese Academy of Sciences；c State Key Laboratory of Structural Chemistry Fujian Institute of Research on the Structure of Matter Chinese Academy of Sciences；Fujian Science&Technology Innovation Laboratory for Optoelectronic Information of China；Accepted on December10 2021）.State-to-State Quantum Dynamical Study of H+Br₂→HBr+Br Reaction^†[J].化学物理学报(英文版),2021,第6期龙风琴^1,2，金坦³，韩克利¹，庄巍³（中国科学院大连化学物理研究所分子反应动力学国家重点实验室；中国科学院大学；中国科学院福建物质结构研究所结构化学国家重点实验室）.硼酸盐对抗冻糖蛋白结构的影响[J].化学物理学报(英文版),2021,第6期高亮，步宇翔（山东大学化学与化工学院）.环丁烷嘧啶二聚体电子催化修复的分子动力学模拟探索[J].化学物理学报(英文版),2021,第6期首页上一页 1 2 3 4 5 下一页尾页共有8页，转到页

期刊文章列表