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  • New Insight into the Hydrogen Bond Effects in One of PRODAN Derivatives (1a) on Excited State in Methanol Solvent

    Yang Liu, Dan Zhao, Jiawei Gao & Zhen Zhao
    2019-04-09
    31207 2901 Pages:53-57
  • The Weakening or Enhancing of $N$-$H\cdots O$ Intermolecular Hydrogen Bond in Different Solvents Revealed by Density Functional Calculations

    Donglin Li, Yufang Liu
    2022-06-15
    28877 2946 Pages:164-171
  • Theoretical Elaboration about Excited State Behaviors and Fluoride Anion Sensor Mechanism for 2-{[2-(2-Hydroxy-Phenyl)-1H-Benzoimidazo-5-yl]-Phenyl-Methylene} Malononitrile

    Jia Li, Xiaodong Li, Shibo Cheng, Peng Song & Jinfeng Zhao
    2018-10-04
    30592 3450 Pages:1-6
  • The Coulomb Attraction in Hydrogen May Not Be of Long Range

    Cheng-Gang Gu
    2010-01-01
    27551 2701 Pages:325-336
  • Integrated Co-Ni-Se Network on Ni Foam as an Efficient Electrocatalyst for Alkaline Hydrogen Evolution

    Shu Liu, Hanfei Zhang, Yi Wu, Rongxing He & Ming Li
    2019-04-09
    62567 4909 Pages:4-6
  • Theoretical Insights into the Excited State Hydrogen Bond and ESIPT Reaction for 2-Amino-3-(2’-Benzoxazolyl)Quinoline and 2-Amino-3-(2’-Benzothiazolyl)-Quinoline

    Qiaoli Zhang, Guang Yang, Xiaoyan Song, Jinfeng Zhao & Dapeng Yang
    2018-10-04
    30495 3589 Pages:7-12
  • Three-Body Dispersion Coefficients for Excited Hydrogen Atoms

    Shi-Zhong Huang, Qiu-Feng Sun
    2011-02-01
    33315 2914 Pages:325-333
  • Full Atomic Theory of Cold Fusion

    Qing-Quan Gou
    2018-08-15
    28838 4272 Pages:87-92
  • Relativistic Theory of One- and Two Electron Systems: Valley of Stability in the Helium-Like Ions

    I. Sakho
    2012-03-01
    28325 3182 Pages:23-40
  • The Solvent Effects on the Energy Gap Between the $n\pi^*$ State and $\pi\pi^*$ State and Fluorescence of Benzoyleneurea

    Songqiu Yang & Jianyong Liu
    2019-01-30
    32947 2806 Pages:33-38
  • SDCS Quantum Mechanical Flux Formula Revisited for Electron-Hydrogen Ionization

    L. U. Ancarani, J. M. Randazzo
    2013-04-01
    29554 2870 Pages:193-209
  • On Computation for a Hydrogen Atom in Arbitrary Magnetic Fields Using Finite Volume Method

    Gyanendra P. Sasmal
    2014-05-01
    31149 2703 Pages:187-205
  • Modulating N-H-Based Excited-State Intramolecular Proton Transfer by Different Electron-Donating/Withdrawing Substituents in 2-(2’-Aminophenyl)Benzothiazole Compounds

    Dapeng Yang, Guang Yang, Min Jia, Xiaoyan Song, Qiaoli Zhang & Tianjie Zhang
    2018-10-04
    29962 3415 Pages:17-20
  • Theoretical Comparative Study on Hydrogen Storage of $BC_3$ and Carbon Nanotubes

    Xiu-Ying Liu, Li-Ying Zhang, Xiao-Feng Li, Guang-Sheng Kang, Zhi-Qin Fan
    2012-03-01
    26177 2440 Pages:367-374
  • Spin Effects in Laser-Assisted Semirelativistic Excitation of Atomic Hydrogen by Electronic Impact

    M. El Idrissi, S. Taj, B. Manaut, Y. Attaourti, L. Oufni
    2021-02-23
    30033 3244 Pages:95-104
  • An Investigation of Excited-State Intramolecular Proton Transfer Mechanism of New Chromophore

    Yanling Cui, Pengyu Li, Jing Wang, Peng Song, Lixin Xia
    2018-08-15
    29525 2990 Pages:23-33
  • The Study on Ionization of Hydrogen Atoms in a Laser Field Considering Non-Dipole Approximation and Coulomb Corrections

    Jian Li, Yining Huo, Fengcai Ma
    2018-07-10
    27529 2678 Pages:110-112
  • Revealing a New Mechanism Feature of F⁻+CH3Cl→Cl⁻+CH3F Reaction by Using Ab Initio Molecular Dynamics

    Yongfang Li, Dun-You Wang
    2018-07-10
    25774 2377 Pages:136-140
  • TDDFT Assessment of Excited State Intramolecular Proton Transfer in a Panel of Chromophore 2-Hydroxypyrene-1-Carbaldehyde

    Hui Li, Hang Yin, Xiaochun Liu, Ying Shi
    2016-07-01
    28801 2708 Pages:115-124
  • Binding Difference of Inhibitors ACD and TDZ to A-FABP Revealed by Molecular Dynamics Simulations

    Fangfang Yan, Xinguo Liu, Shaolong Zhang, Jing Su, Qinggang Zhang, Jianzhong Chen
    2018-07-10
    28348 2758 Pages:97-104
  • Excited State Process of a Novel NIR-BODI Molecule in Toluene and Acetonitrile Solvents: A Theoretical Study

    Jia Li, Meixia Zhang, Can Du, Peng Song & Xiaodong Li
    2018-07-10
    27860 2802 Pages:162-168
  • Coulomb Divergence in S-Matrix Expansion of Above-Threshold Ionization

    Mingqing Liu, Zheng Shu, Bobin Li, Shilin Hu, Jing Chen
    2017-08-01
    31211 3841 Pages:5-9
  • High-Order Harmonics and Isolated-Attosecond Pulse Generation of Three-Dimensional H Atom by UV-Assisted Chirped Fields

    Hong-Dan Zhang, Jing Guo, Hui-Ying Zhong, Xiang-Yi Luo, Hui Du, Yan Shi, Xuri Huang, Xue-Shen Liu
    2016-07-01
    28812 2701 Pages:135-145
  • Theoretical Exploration of the Interference Minimum in Molecular High-Order Harmonic Generation

    Liqing Li, Yuanyuan Xu, Xiangyang Miao
    2016-07-01
    28754 3368 Pages:1-10
  • A Theoretical Analysis of the Nonadiabatic Photodissociation of HF and DF Molecules: Fine-Structure Distributions of the $F(^2P_J)$ Product

    Yuan-Jun Li, Pei-Yu Zhang, Ke-Li Han
    2018-08-15
    28197 3401 Pages:18-40
  • Sulfoxides as Response Elements for Fluorescent Chemosensors: Does It Work?

    Jun-Sheng Chen, Li Zhao, Yang Yang, Tian-Shu Chu
    2018-08-15
    29427 3257 Pages:1-10
  • Anisotropy of Ternary and (Zr,Ga) Addition Magnetic Powders

    Min Liu
    2021-02-23
    27189 2628 Pages:338-344
1 - 27 of 45 items 1 2 > >> 
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