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期刊文章列表

  • Jia-jun Ren,Yuan-heng Wang,Wei-tang Li,Tong Jiang,Zhi-gang Shuai(MOE Key Laboratory of Organic OptoElectronics and Molecular Engineering,Department of Chemistry,Tsinghua University Beijing 100084,China).Time-Dependent Density Matrix Renormalization Group Coupled withn-Mode Representation Potentials for the Excited State Radiationless Decay Rate:Formalism and Application to Azulene[J].化学物理学报(英文版),2021,第5期
  • Yue-Chao Wang,Hong Jiang(Beijing National Laboratory for Molecular Sciences,Institute of Theoretical and Computational Chem-istry,College of Chemistry and Molecular Engineering,Peking University,Beijing 100871,China).Constrained Density Functional Theory Plus the Hubbard U Correction Approach for the Electronic Polaron Mobility:A Case Study of TiO2[J].化学物理学报(英文版),2021,第5期
  • Jie Kong,Yan-zhen Wu,Meng Zhou(Hefei National Laboratory for Physical Sciences at the Microscale,University of Science and Technology of China,Hefei 230026,China).Coherent Vibrational Dynamics of[Au25(SR)18]-Nanoclusters[J].化学物理学报(英文版),2021,第5期
  • Wen-huan Zhu,Zhong-kai Huang,Mao-lin Bo,Jin Huang,Cheng Peng,Hai Liu(National Key Laboratory of Science and Technology on Micro/Nano Fabrication,Shanghai Jiao Tong University,Shanghai 200240,China;Key Laboratory of Inorganic Special Functional Materials of Chongqing,Yangtze Nromal University,Chongqing 408100,China;Key Laboratory of Extraordinary Bond Engineering and Advanced Materials Technology of Chongqing,Yangtze Normal University,Chongqing 408100,China;School of Chemistry and Chemical Engineering,Southwest University,Chongqing 400715,China;Key Laboratory of Extraordinary Bond Engineering and Advanced Materials Technology of Chongqing,Yangtze Normal University,Chongqing 408100,China;School of Chemistry and Chemical Engineering,Southwest University,Chongqing 400715,China;Key Laboratory of Advanced Display and System Applications of Ministry of Education,Shanghai University,Shanghai 200072,China).Surface,Size and Thermal Effects in Alkali Metal with Core-Electron Binding-Energy Shifts[J].化学物理学报(英文版),2021,第5期
  • Xiao-you Niu,Shen-long Jiang,Qun Zhang(Hefei National Laboratory for Physical Sciences at the Microscale, Department of Chemical Physics,Synergetic Innovation Center of Quantum Information and Quantum Physics, University of Science and Technology of China).Photocatalytic N2 Fixation by Plasmonic Mo-Doped TiO2 Semiconductor[J].化学物理学报,2021,第4期
  • Chen Wang,Ming-chen Xiong,Xuan Zhao,Kun-hui Liu(College of Chemistry, Beijing Normal University).Kinetics Study on Reaction of Atenolol with Singlet Oxygen by Directly Monitoring the 1O2 Phosphorescence[J].化学物理学报,2021,第4期
  • Yan-dong Tan,Cun-feng Cheng,Dong Sheng,Shui-ming Hu(Department of Precision Machinery and Precision Instrumentation, University of Science and Technology of China;Hefei National Laboratory for Physical Sciences at the Microscale, University of Science and Technology of China).Detection of Radiocarbon Dioxide with Double-Resonance Absorption Spectroscopy[J].化学物理学报,2021,第4期
  • Liang Zhu,Bin Li,Lei Dong,Wei Feng,Ai-di Zhao,Bing Wang(Hefei National Laboratory for Physical Sciences at the Microscale and Synergetic Innovation Center of Quantum Information&Quantum Physics,University of Science and Technology of China).Controlling Metalation Reaction of Phthalocyanine with Cobalt at Single-Molecule Level on Au(111) Surface[J].Chinese Journal of Chemical Physics,2021,第4期
  • Tai Qin,Jun-fei Xue,Lily Zu(College of Chemistry, Beijing Normal University).Structural Effect on Electron Impact Decomposition of 1,3- and 1,4-Cyclohexane Dinitrites[J].化学物理学报,2021,第4期
  • Zi-kai Hao,Hai-feng Lv,Da-yong Wang,Xiao-jun Wu(Hefei National Laboratory for Physical Science at the Microscale, School of Chemistry and Materials Sciences, CAS Key Laboratory of Materials for Energy Conversion, and CAS Center for Excellence in Nanoscience, University of Science and Technology of China;Synergetic Innovation Center of Quantum Information & Quantum Physics, University of Science and Technology of China).High-Performance Chemical Information Database towards Accelerating Discovery of Metal-Organic Frameworks for Gas Adsorption with Machine Learning[J].化学物理学报,2021,第4期
  • Lin Chen,Yuan-ming Li,Min Zheng,Xin Wei,Lin Wang(School of Physics and Materials Engineering, Hefei Normal University;Hefei National Laboratory for Physical Sciences at the Microscale and Department of Chemical Physics, University of Science and Technology of China).pH Dependence of Photochemical Kinetics of Thioxanthen-9-one from Nanosecond Time-resolved Laser Flash Photolysis[J].化学物理学报,2021,第4期
  • Yu-feng Wang,Tian-yu Du,Dong-xu Dai,Chun-lei Xiao,Xue-ming 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 Beijing 100049 China;c College of Science Southern University of Science and Technology).A Slow and Clean Fluorine Atom Beam Source Based on Ultraviolet Laser Photolysis[J].化学物理学报,2021,第4期
  • Wen-peng Yuan,Bai-hui Feng,Dong-yuan Yang,Yan-jun Min,Sheng-rui Yu,Guo-rong Wu,Xue-ming Yang(Hangzhou Institute of Advanced Studies Zhejiang Normal University;State Key Laboratory of Molecular Reaction Dynamics Dalian Institute of Chemical Physics;University of Chinese Academy of Sciences).Ultrafast Decay Dynamics of N-Ethylpyrrole Excited to the S1 Electronic State: A Femtosecond Time-Resolved Photoelectron Imaging Study[J].化学物理学报,2021,第4期
  • Wei Fan,Xiao-dong Chen,Li-ming Liu,Ning Chen,Xiao-guo Zhou,Zhi-hong Zhang,Shi-lin Liu(Hefei National Laboratory for Physical Sciences at the Microscale iChEM (Collaborative Innovation Center of Chemistry for Energy Materials) Department of Chemical Physics University of Science and Technology of China;School of Physics and Optoelectronics Engineering Ludong University).Concentration-Dependent Influence of Silver Nanoparticles on Amyloid Fibrillation Kinetics of Hen Egg-White Lysozyme[J].Chinese Journal of Chemical Physics,2021,第4期
  • Jun-ben Weng,Chen-yi Liao,Yan Li,Ding-lin Zhang,Guo-hui Li,An-hui Wang(Laboratory of Molecular Modeling and DesignState Key Laboratory of Molecular Reaction DynamicsDalian Institute of Chemical Physics Chinese Academy of Sciences;University of Chinese Academy of Sciences;State Key Laboratory of Fine Chemicals School of Chemistry Dalian University of Technology).Effect of Protein Dimerization on Ion Conductivity of Gramicidin A Channel Studied Using Polarizable Force Field[J].化学物理学报,2021,第4期
  • Xin-zheng Du,Xin-fan Hua,Zhi-yong Zhang(MOE Key Laboratory for Membraneless & Cellular Dynamics, National Science Center for Physical Sciences at the Microscale,Division of Life Sciences and Medicine,University of Science and Technology of China).Choice of Force Fields and Water Models for Sampling Solution Conformations of Bacteriophage T4 Lysozyme[J].化学物理学报,2021,第4期
  • Yao Wang,Yu Su,Rui-Xue Xu,Xiao Zheng,YiJing Yan(Hefei National Laboratory for Physical Sciences at the Microscale and Department of Chemical Physics and Synergetic Innovation Center of Quantum Information and Quantum Physics and Collaborative Innovation Center of Chemistry for Energy Materials (iChEM), University of Science and Technology of China).Marcus’ Electron Transfer Rate Revisited via a Rice-Ramsperger-Kassel-Marcus Analogue: A Unified Formalism for Linear and Nonlinear Solvation Scenarios[J].Chinese Journal of Chemical Physics,2021,第4期
  • Jun-hua Fang,Wen-bin Fan,Hui Yang,Jia-ning Song,Yong-le Li(Department of Chemistry Shanghai University;Department of Physics International Center for Quantum and Molecular Structures and Shanghai Key Laboratory of High Temperature Superconductors Shanghai University).Rate Coefficients and Kinetic Isotope Effects of Cl+XCl→XCl+Cl (X=H,D, Mu) Reactions from Ring Polymer Molecular Dynamics[J].化学物理学报(英文版),2021,第4期
  • 翁俊贲1,2,廖晨伊1,李焱1,张鼎林1,李国辉1,王安辉1,3(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;大连理工大学化学学院精细化工国家重点实验室).基于AMOEBA可极化力场研究蛋白二聚化对于gramicidin A通道电导的影响[J].化学物理学报(英文版),2021,第4期
  • Noor Rehman1,Zia Ul Haq2,Hidayat Ullah1,Inamullah Mian3,Xian Li3(巴基斯坦Shaheed BB University化学系 巴基斯坦戈梅尔大学化学系;新疆大学化学和与化学工程学院).阳离子表面活性剂三甲基溴化铵与硝酸铵相互作用的表面和热力学研究[J].化学物理学报(英文版),2021,第4期
  • Noor Rehman,Zia Ul Haq,Hidayat Ullah,Inamullah Mian,Xian Li(Department of Chemistry, Shaheed BB University, Sheringal;Department of Chemistry, Gomal University;Key Laboratory of Coal Clean Conversion and Chemical Process Autonomous Region, College of Chemistry and Chemical Engineering, Xinjiang University).Interactions of Cationic Surfactant Cetyl-trimethyl ammonium bromide with Ammonium nitrate: Surface and Thermodynamic Studies[J].化学物理学报,2021,第4期
  • 谭延东1,程存峰2,盛东1,2,胡水明2(中国科学技术大学精密机械与精密仪器系;中国科学技术大学合肥微尺度物质科学国家研究中心).基于双共振吸收光谱法的14CO2探测[J].化学物理学报(英文版),2021,第4期
  • 袁文鹏1,2,冯柏慧2,3,杨栋元2,闵彦钧2,3,俞盛锐1,吴国荣2,杨学明2(浙江师范大学杭州高等研究院;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).N-乙基吡咯S1态超快动力学:飞秒时间分辨光电子成像研究[J].化学物理学报(英文版),2021,第4期
  • 范伟1,陈晓栋1,刘力铭1,陈宁1,周晓国1,张志红2,刘世林1(中国科学技术大学化学物理系合肥微尺度物质科学国家研究中心;鲁东大学物理与光电子工程学院).银纳米颗粒对溶菌酶纤维化影响的浓度效应[J].化学物理学报(英文版),2021,第4期
  • 王琛,熊明琛,赵璇,刘坤辉(北京师范大学化学学院).瞬态磷光发射光谱研究阿替洛尔与单线态氧反应的动力学[J].化学物理学报(英文版),2021,第4期
  • 牛孝友,江申龙,张群(中国科学技术大学化学物理系合肥微尺度物质科学国家研究中心量子信息与量子物理协同创新中心).等离激元钼掺杂二氧化钛半导体的光催化固氮反应机理研究[J].化学物理学报(英文版),2021,第4期
  • 郝梓凯,吕海峰,王大勇,武晓君(中国科学技术大学化学与材料科学学院合肥微尺度物质科学国家研究中心量子信息与量子科技前沿协同创新中心中国科学院能量转换材料重点实验室中国科学院纳米科学卓越创新中心).机器学习辅助高性能化学信息数据库促进金属有机框架材料基气体吸附材料筛选[J].化学物理学报(英文版),2021,第4期
  • 陈琳1,李元铭2,郑敏2,魏薪1,王琳1(合肥师范学院物理与材料工程学院;中国科学技术大学化学物理系合肥微尺度物质科学国家研究中心).利用纳秒激光闪光光解技术研究噻吨酮光化学动力学的pH值效应[J].化学物理学报(英文版),2021,第4期
  • 方俊华1,范文斌2,杨慧2,宋佳宁2,李永乐2(上海大学化学系;上海大学物理系上海高温超导体重点实验室量子与分子结构国际研究中心).基于串珠分子动力学的Cl+XCl→XCl+Cl(X=H,D,Mu)反应的速率系数和动力学同位素效应研究[J].化学物理学报(英文版),2021,第4期
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