• Single Pt Atoms Supported on Oxidized Graphene (Pt1/Gr-O) as a Promising Catalyst for Hydrolysis of Ammonia Borane
    Hong Wu, Qiquan Luo, Ruiqi Zhang, Wenhua Zhang*, Jinlong Yang*
    Understanding the catalytic mechanism and design of novel catalysts are of great significance for the full hydrolysis of one ammonia borane (NH3BH3) to produce three hydrogen molecules at room temperature. In this work, we theoretically investigate the full hydrolysis one NH3BH3 molecule on designed single Pt atoms supported on oxidized Graphene (Pt1/Gr-O). Based on the full hydrolysis mechanism of NH3BH3, it is suggested that the rate-limiting step of the whole pro...
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    Chin. J. Chem. Phys: 2018 ,Issue 5,Page:0~0HTML
  • Location Effect in a Photocatalytic Hybrid System of Metal-Organic Framework Interfaced with Semiconductor Nanoparticles
    Qi-chao Shang, Xin-zuo Fang, Hai-long Jiang and Qun Zhang*
    Chin. J. Chem. Phys: 2018 ,Issue 5,Page:613~618HTML
  • Experimental and Theoretical Study on Dissociative Photoionization of Cyclopentanone
    Zhao-hui Li, Ye-peng Yu, Xuan Lin, Jun Chen, Hang Zhang, Yan-bo Li, Huan-huan Wang, Qing-hui Meng, Rui-rui Sun, Xiao-bin Shan, Fu-yi Liu* and Liu-si Sheng
    Chin. J. Chem. Phys: 2018 ,Issue 5,Page:619~625HTML
  • Electrochemical Study on Hydrogen Evolution and CO2 Reduction on Pt Electrode in Acid Solutions with Different pH
    Jing Yang, Jie Wei, Wei Chen and Yan-xia Chen*
    Chin. J. Chem. Phys: 2018 ,Issue 5,Page:626~634HTML
  • Effect of a Single Repeat Sequence of the Human Telomere d(TTAGGG) on Structure of Single-Stranded Telomeric DNA d[AGGG(TTAGGG)6]
    Tian-lei Guang, Ya-ting Gao and Xiao-dong Ye*
    Chin. J. Chem. Phys: 2018 ,Issue 5,Page:635~640HTML
  • Single Pt Atoms Supported on Oxidized Graphene as a Promising Catalyst for Hydrolysis of Ammonia Borane
    Hong Wu, Qi-quan Luo, Rui-qi Zhang, Wen-hua Zhang* and Jin-long Yang*
    Chin. J. Chem. Phys: 2018 ,Issue 5,Page:641~648HTML
  • Enhanced Oxygen Reduction on Graphene via Y5Si3 Electride Substrate: a First-Principles Study
    Jing-jing Lin, Hai-feng Lv and Xiao-jun Wu*
    Chin. J. Chem. Phys: 2018 ,Issue 5,Page:649~654HTML
  • Simulation Study of Electron Beam Induced Surface Plasmon Excitation at Nanoparticles
    Zhe Zheng, Bo Da*, Ke-jun Zhang and Ze-jun Ding*
    Chin. J. Chem. Phys: 2018 ,Issue 5,Page:655~660HTML
  • Multi-Physics Modeling Assisted Design of Non-Coking Anode for Planar Solid Oxide Fuel Cell Fueled by Low Steam Methane
    Jiang Zhu, Bao-xuan Wang and Zi-jing Lin*
    Chin. J. Chem. Phys: 2018 ,Issue 5,Page:661~666HTML
  • Solvent-Triggered Self-Folding of Hydrogel Sheets
    Shuai Qin, Li-wei Hui, Li-hua Yang* and Ming-ming Ma*
    Chin. J. Chem. Phys: 2018 ,Issue 5,Page:667~672HTML
  • Layer-Structured Ti Doped O3-Na1-xCr1-xTixO2(x=0, 0.03, 0.05) with Excellent Electrochemical Performance as Cathode Materials for Sodium Ion Batteries
    Yu Shao, Zhong-feng Tang, Jia-ying Liao and Chun-hua Chen
    Chin. J. Chem. Phys: 2018 ,Issue 5,Page:673~676HTML
  • Coordinate Bond Breaking Induced by Collapse of Poly(N-isopropyl acrylamide) as Ligands of a Rare Earth Complex
    Tian-yu Song, Yan-yang Zhu, Shuo-feng Liang, Gang Zou* and Qi-jin Zhang*
    Chin. J. Chem. Phys: 2018 ,Issue 5,Page:677~683HTML
  • Stabilization of Aqueous Graphene Oxide with Acetone under γ-Ray/UV Irradiation
    Hong Qin, Qin-yi Zhu and He-wen Liu*
    Chin. J. Chem. Phys: 2018 ,Issue 5,Page:684~690HTML
  • UV Laser Regulation of Surface Oxygen Vacancy of CoFe2O4 for Enhanced Oxygen Evolution Reaction
    Zhen-hong Xiao, Dao-chuan Jiang, Han Xu, Jing-tian Zhou, Qi-zhong Zhang, Ping-wu Du, Zhen-lin Luo* and Chen Gao
    Chin. J. Chem. Phys: 2018 ,Issue 5,Page:691~694HTML
  • Ag-Cu Nanoparticles Supported on N-Doped TiO2 Nanowire Arrays for Effcient Photocatalytic CO2 Reduction
    Xiao-nong Wang, Jun Ma, Yang-guang Hu, Ran Long* and Yu-jie Xiong*
    Chin. J. Chem. Phys: 2018 ,Issue 5,Page:695~700HTML
  • Gamma Ray Radiation Effect on Bi2WO6 Photocatalyst
    Qiang Zhang, Zhi-wen Jiang, Mo-zhen Wang* and Xue-wu Ge*
    Chin. J. Chem. Phys: 2018 ,Issue 5,Page:701~706HTML
  • 3D Macro-Micro-Mesoporous FeC2O4/Graphene Hydrogel Electrode for High-Performance 2.5 V Aqueous Asymmetric Supercapacitors
    Wei-shuai Liu, Yu-qing Song, Heng Wang, Hong-fei Wang and Li-feng Yan*
    Chin. J. Chem. Phys: 2018 ,Issue 5,Page:707~716HTML
  • Gd Doped Hollow Nanoscale Coordination Polymers as Multimodal Imaging Agents and a Potential Drug Delivery Carriers
    Gao-zheng Zhao, Zhen Guo* and Qian-wang Chen*
    Chin. J. Chem. Phys: 2018 ,Issue 5,Page:717~724HTML
  • Extraction of Lignin from Tobacco Stem using Ionic Liquid
    Ming-hui Fan, Shao-lin Ge, Zhao Zhang, Ying-song Xie and Quan-xin Li*
    Chin. J. Chem. Phys: 2018 ,Issue 5,Page:725~730HTML
  • A Simple, Compact and Rigid Scanning Tunneling Microscope
    Wei-feng Ge, Ji-hao Wang, Yu-bin Hou and Qing-you Lu*
    Chin. J. Chem. Phys: 2018 ,Issue 5,Page:731~734HTML
  • Chinese Abstracts
    Chin. J. Chem. Phys: 2018 ,Issue 5,Page:735~735HTML
  • CJCP1811254Infrared Photodissociation Spectroscopic and Theoretical study of the HC2nO+ (n=3-6) Cations
    周鸣飞
  • CJCP1809213Density functional theory study of the selectivity of crown ethers to Li+ in spent lithium-ion batteries leaching solutions
    TongBihai
  • CJCP1811256Rate Coefficients and Branching Ratio for Multi-Channel Hydrogen Abstractions from CH3OH by F
    jli15
  • CJCP1811252Unraveling Vibrational Wavepacket Dynamics using Femtosecond Ion Yield Spectroscopy and Photoelectron Imaging
    张冰
  • CJCP1811251Crossed Molecular Beam Study of the F+D2(v=1,j=0)Reaction
    Xiao Chun-lei
  • CJCP1811249Theoretical study on quantum dynamics for the Ar–HF inelastic collision
    谢代前
  • CJCP1811248Solvent-Induced Symmetry-Breaking Charge Transfer in an Octupolar Triphenylamine Derivative Resolved with Transient Fluorescence Spectroscopy
    Andong Xia
  • CJCP1809209A first-principles study of Pd single-atom catalysis of reverse hydrogen spillover mechanism on the MgH 2(110) surface
    Wei Hu
  • CJCP1811244A phosphorene-based van der Waals heterojunction for solar water splitting
    李群祥
  • CJCP1810231Crystallization, Vitri cation, and Gelation of Patchy Colloidal Particles
    Wang Haijun
  • CJCP1810229Superabsorbent Capability and High Retention Ability of China Clay (Kaolinite) /Polyacrylic acid Composites for Aqueous Solution
    Tanveer-Ul-Hassan Shah
  • CJCP1810227First-Principles Study of Two Dimensional Transition Metal Phthalocyanine-Based Metal-Organic Frameworks in Kagome Lattice
    Bin Li
  • CJCP1810220Dual Manipulation of Ferromagnetism in Co-Doped ZnO Thin Films by Surfactant and n-Type Carriers
    QinghuaLiu
  • CJCP1809212Two-dimensional VDW Crystal SnP3 with High Carrier Mobility and Extraordinary Sunlight Absorbance
    Erjun Kan
  • CJCP1809211o-C8 Carbon: A New Allotrope of Superhard Carbon
    Gan Li-Hua
  • CJCP1808186Ring-polymer molecular dynamics studies of thermal rate coefficients for the reaction F + H2O → HF + OH
    jli15
  • CJCP1808193Highly Effective Detection of Amitraz in Honey by Using Surface-Enhanced Raman Scattering Spectroscopy Coupled with Chemometric Methods
    Xingming Nie
  • CJCP1808192Imaging HNCO Photodissociation at 201 nm: State-to-State Correlations between CO (X1Σ+) and NH (a1Δ)
    Zhang Zhi-Guo
  • CJCP1808189In-situ investigations of the interfacial degradation and the ion migration at perovskite/Ag interfaces
    Huanxin Ju
  • CJCP1807182Fluorescence Emission Mediated by Metal-Dielectric-Metal Fishnet Metasurface: Spatially Selective Excitation and Double Enhancement
    LuYonghua
  • CJCP1807179Strong current-polarization and differential negative resistance in FeN3 –embedded armchair graphene nanoribbons
    李小飞
  • CJCP1807177Channel-Resolved Ultrafast Dissociation Dynamics of NO2 Molecules Studied via Femtosecond Time-Resolved Ion Imaging
    Sizuo Luo
  • CJCP1807172A hierarchical{equation{of{motion based semiclassical approach to quantum dissipation
    徐瑞雪
  • CJCP1807171Photo-induced intermolecular electron transfer - the effect of acceptor molecular structures
    杨延强
  • CJCP1807167Near-field Scattering Enhancement of Perylene Based Aggregates for Random Lasing
    Zhangzhenzhen
  • CJCP1806155Ultrafast investigation of excited-state dynamics in trans-4-methoxyazobenzene studied by femtosecond transient absorption spectroscopy
    zhangsong
  • CJCP1806149Average Arrival Time: An Alternative Approach for Studying Fluorescent Behavior of Single Quantum Dots
    Jing Zhao
  • CJCP1806148Mode-coupling Theory for Glass Transition of Active-passive Binary Mixture
    Zhonghuai Hou
  • CJCP1806146Exact generator and its high order expansions in the time-convolutionless generalized master equation: Applications to the spin-boson model and exictation energy transfer
    Qiang Shi
  • CJCP1806143Intracellular self-assembly of TPE-biotin nanoparticles enables aggregation-induced emission fluorescence for cancer-targeted imaging
    JiangJinhui
  • CJCP1806142Energy-transfer Processes of the 6p[1/2]0, 6p[3/2]2, and 6p[5/2]2 Atoms under the Condition of Ultrahigh Pumped Power
    Shine He
  • CJCP1806140Ultraviolet optical properties and Structural characteristics of RF-deposited HfO2 thin films
    RongdunHong
  • CJCP1806134Investigation of intrachain exciton diffusion of MEH-PPV in solution with different polarity
    HanzhuangZhang
  • CJCP1806133A facile surface passivation of hematite photoanodes with molybdate overlayers for efficient PEC water oxidation
    xuesong
  • CJCP1805130PMOXA/PAA brushes toward on-line preconcentration for BSA in capillary electrophoresis
    Yanmei Wang
  • CJCP1805095Polyaniline nanotubes prepared by one-step synergistic polymerization of aniline and acrylic acid
    Wang Mo-Zhen
  • CJCP1805116Electrosynthesis of CuO Nanocrystal Array as a Highly Efficient and Stable Electrocatalyst for Oxygen Evolution Reaction
    MaMingming
  • CJCP1805115Using self-referencing interlaced submatrices to determine the number of chemical species in a mixture
    邵利民
  • CJCP1805113Solution-based Synthesis of NiSb nanoparticles for Electrochemical Activity in Hydrogen Evolution Reaction
    杨晴
  • CJCP1805105Mesoporous MnSiO3@Fe3O4@C Nanoparticle as pH-responsive T1-T2* Dual-modal Magnetic Resonance Imaging Contrast Agent for Tumor Diagnosis
    Qianwang Chen
  • CJCP1805104Metal-organic frameworks derived Ag-CoSO4 nanohybrids as efficient electrocatalysts for oxygen evolution reaction
    Qianwang Chen
  • CJCP1805089Photoionization and dissociation study of 2-methyl-2-propen-1-ol: Experimental and theoretical insights
    Liu Fu-yi
  • CJCP1804076A First-principles Study of Ultrathin Molybdenum Sulfides Nanowires: Electronic and Catalytic Hydrogen Evolution Properties
    武晓君
  • CJCP1804070New Insights into the Folding Kinetics of α, ω dye-functionalized Poly(N-isopropylacrylamide)
    叶晓东
  • CJCP1804064pH Effect on the Oxidation of Hydrogen Peroxide at Au(111) Electrode in Alkaline Solutions
    陈艳霞
  • CJCP1804061“Dry” NiCo2O4 nanorods for electrochemical non-enzymatic glucose sensoring
    Zhou Yan
  • CJCP1803040Direct observation of TiSe2、MoTe2 and TaS2 in solution with scanning tunneling microscope
    陆轻铀
  • CJCP1803028Renewable P-xylene Production by Co-catalytic Pyrolysis of Cellulose and Methanol
    李全新
  • CJCP1802019Unexpected Chemistry from the Homogeneous Thermal Decomposition of Acetylene: An ab initio study
    Ding Jun-Xia
  • CJCP1801002Monte Carlo simulation of the coil -to -globule transition of compact polymer chains: role of monomer interacting
    Jiaye Su
  • CJCP1804064 pH Effect on the Oxidation of Hydrogen Peroxide at Au(111) Electrode in Alkaline Solutions
    陈艳霞
  • CJCP1806133 A facile surface passivation of hematite photoanodes with molybdate overlayers for efficient PEC water oxidation
    xuesong
  • CJCP1808192 Imaging HNCO Photodissociation at 201 nm: State-to-State Correlations between CO (X1Σ+) and NH (a1Δ)
    Zhang Zhi-Guo
  • CJCP1806143 Intracellular self-assembly of TPE-biotin nanoparticles enables aggregation-induced emission fluorescence for cancer-targeted imaging
    JiangJinhui
  • CJCP1805116 Electrosynthesis of CuO Nanocrystal Array as a Highly Efficient and Stable Electrocatalyst for Oxygen Evolution Reaction
    MaMingming
  • CJCP1807179 Strong current-polarization and differential negative resistance in FeN3 –embedded armchair graphene nanoribbons
    李小飞
  • CJCP1805115 Using self-referencing interlaced submatrices to determine the number of chemical species in a mixture
    邵利民
  • CJCP1806140 Ultraviolet optical properties and Structural characteristics of RF-deposited HfO2 thin films
    RongdunHong
  • CJCP1806142 Energy-transfer Processes of the 6p[1/2]0, 6p[3/2]2, and 6p[5/2]2 Atoms under the Condition of Ultrahigh Pumped Power
    Shine He
  • CJCP1804070 New Insights into the Folding Kinetics of α, ω dye-functionalized Poly(N-isopropylacrylamide)
    叶晓东
  • CJCP1805095 Polyaniline nanotubes prepared by one-step synergistic polymerization of aniline and acrylic acid
    Wang Mo-Zhen
  • CJCP1807171 Photo-induced intermolecular electron transfer - the effect of acceptor molecular structures
    杨延强
  • CJCP1806155 Ultrafast investigation of excited-state dynamics in trans-4-methoxyazobenzene studied by femtosecond transient absorption spectroscopy
    zhangsong
  • CJCP1804061 “Dry” NiCo2O4 nanorods for electrochemical non-enzymatic glucose sensoring
    Zhou Yan
  • CJCP1806149 Average Arrival Time: An Alternative Approach for Studying Fluorescent Behavior of Single Quantum Dots
    Jing Zhao
  • CJCP1806146 Exact generator and its high order expansions in the time-convolutionless generalized master equation: Applications to the spin-boson model and exictation energy transfer
    Qiang Shi
  • CJCP1806148 Mode-coupling Theory for Glass Transition of Active-passive Binary Mixture
    Zhonghuai Hou
  • CJCP1807172 A hierarchical{equation{of{motion based semiclassical approach to quantum dissipation
    徐瑞雪
  • CJCP1802019 Unexpected Chemistry from the Homogeneous Thermal Decomposition of Acetylene: An ab initio study
    Ding Jun-Xia
  • CJCP1801002 Monte Carlo simulation of the coil -to -globule transition of compact polymer chains: role of monomer interacting
    Jiaye Su
  • CJCP1803028 Renewable P-xylene Production by Co-catalytic Pyrolysis of Cellulose and Methanol
    李全新
  • cjcp1511232 Photoelectron Spectroscopy and Density Functional Calculations of TiGen- (n=7-12) Clusters
    Xiao-jiao Deng, Xiang-yu Kong, Xi-ling Xu, Hong-guang Xu and Wei-jun Zheng
  • cjcp1511240 In situ Detection of Amide A Bands of Proteins in Water by Raman Ratio Spectrum
    Cheng-qian Tang, Ke Lin, Xiao-guo Zhou and Shi-lin Liu
  • cjcp1512238 Infrared Photodisssociation Spectroscopy of Boron Carbonyl Cation Complexes
    Jia-ye Jin, Guan-jun Wang and Ming-fei Zhou
  • cjcp1512242 Excited-State Proton Transfer and Decay in Hydrogen-Bonded Oxazole System:MS-CASPT2//CASSCF Study
    Bin-bin Xie, Chun-xiang Li, Gang-long Cui and Qiu Fang
  • cjcp1512248 Cross-Propagation Sum-Frequency Generation Vibrational Spectroscopy
    Li Fu, Shun-li Chen, Wei Gan and Hong-fei Wang
  • 150618129 Active Sites for Adsorption and Reaction of Molecules on Rutile TiO2(110) and Anatase TiO2(001) Surfaces (cited: 1)
    Shi-jing Tan and Bing Wang*
  • 150617126 Linear and Nonlinear Spectra in Photosynthetic Light Harvesting Complexes: Benchmark Tests of Modi ed Red eld Method
    Yuan-yuan Jing, Kai Song, Shu-ming Bai and Qiang Shi*
  • 150615124 Coherent Control of Multiple 2nd-Order Quantum Pathways (cited:1)
    Fang Gao, Yao-xiong Wang, De-wen Cao and Feng Shuan*
  • 150526108 Counting Radio-Krypton Atoms with a Laser
    Guo-min Yang, Le-yi Tu, Cun-feng Cheng, Xiang-yang Zhang and Shui-ming Hu*
  • 150521105 SP3-Hybridization Feature of Ag4 Superatom in Superatomic Molecules
    Li-juan Yan, Long-jiu Cheng* and Jin-long Yang*
  • cjcp1602023 First-Principles Study of Magnetism in Transition Metal Doped Na0.5Bi0.5TiO3 System
    Lin Ju, Tong-shuai Xu, Yong-jia Zhang and Li Sun
  • cjcp1512243 Photodissociation Dynamics of 2-Iodotoluene Investigated by Femtosecond Time-Resolved Mass Spectrometry
    Zhi-ming Liu, Yan-mei Wang, Chun-long Hu, Jin-you Long and Bing Zhang
  • cjcp1511230 Spin Polarization at Organic-Ferromagnetic Interface: E ect of Contact Con guration
    Ying Li, Guang-ping Zhang, Zhen Xie, Zhao Zhang, Jun-feng Ren, Chuan-kui Wang and Gui-chao Hu
  • cjcp1506116 Crystallization Behavior and Properties of B-Doped ZnO Thin Films Prepared by Sol-Gel Method with Di erent Pyrolysis Temperatures
    Bin Wen, Chao-qian Liu, Nan Wang, Hua-lin Wang, Shi-min Liu, Wei-wei Jiang, Wan-yu Ding, Wei-dong Fei and Wei-ping Chai
  • 150622134 Fractional Pyrolysis of Algae and Model Compounds (cited: 1)
    Lin-ling Li, Rui Zhang, Dong-mei Tong and Chang-wei Hu*
  • 150522106 Full Quantum Theory of Molecular Hot-Electroluminescence in Scanning Tunneling Microscope Tunnel Junctions
    Gong Chen, Xiao-guang Li* and Zhen-chao Dong*
  • 150518100 First-Principles Study on Electronic and Optical Properties of Graphene-Like Boron Phosphide Sheets
    Shao-feng Wang and Xiao-jun Wu*
  • 150330054 Solvent Effect on the Photoinduced Electron Transfer Reaction Between Thioxanthen-9-one and Diphenylamine
    Lin Chen, Qiao-hui Zhou, Xiang Liu, Xiao-guo Zhou* and Shi-lin Liu
  • 150319045 Electronic Structure and Circular Dichroism of Natural Alboatisins Isolated from Aerial Parts of Isodon Albopilosus: DFT and TDDFT Study
    Gao-zhang Gou*, Bo Zhou, Ling Shi, Shao-ming Chi, Xian-lan Chen and Wei Liu*
  • 150312039 Theoretical Analysis on Optical Limiting Properties of Newly Synthesized Graphene Oxide-Porphyrin Composites (cited:2)
    Yu-jin Zhang, Wen-jing Yang, Jian-zhong Fan, Yu-zhi Song and Chuan-kui Wang*
  • 141115197 Computational Exploration of Conformations of Glycine-Arginine and a Deduced Model on Global Minimum Configurations of Dipeptides in Gas Phase
    Kai-yi Yang, Bing Yang and Zi-jing Lin*
  • 141010175 Electron Momentum Spectroscopy of Outer Valence Orbitals of 2-Fluoroethanol
    Yu-feng Shi, Xu Shan*, En-liang Wang, Hong-jiang Yang, Wei Zhang and Xiang-jun Chen
  • 141009174 A Highly Stable Electrochemical Scanning Tunneling Microscope
    Zhigang Xia, Jihao Wang, Yubin Hou and Qingyou Lu