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  • Structural Stability and Electronic Structure of N- or C-Monodoped $TiO_2$ from First-Principles Calculations

    Chao-Hua Ma, Xin-Guo Ma, Cheng-Guo Li & Ling Miao
    2018-08-15
    27513 3607 Pages:78-86
  • Accurate Ab Initio-Based Potential Energy Curve and Spectroscopic Properties of NO(X2Π) via Extrapolation to the Complete Basis Set Limit

    H.Y. Ma , L. Guo , Q. Guo & Y. Q. Li
    2017-08-01
    27686 2709 Pages:75-83
  • Accurate Potential Energy Function and Spectroscopic Properties of NS (X2Π) via Extrapolation to the Complete Basis Set Limit

    L. Guo, H.Y. Ma, W. Shi, L. L. Zhang, Y. Z. Song, Q. Guo, Y. Q. Li
    2017-08-01
    27187 2546 Pages:88-96
  • Inverse Halogen Bonds Intermolecular Interactions

    Yan-Zhi Liu, Su-Rui Zhao, Xiao-Ning Dong, Kun Yuan, Hui-An Tang, Guo-Fang Zuo, Yuan-Cheng Zhu, Xin-Wen Liu
    2011-02-01
    25971 2467 Pages:234-240
  • Properties and Phase Transitions of the Solid $\beta$-HMX: Different Force Fields

    Shuo Liu, Jing Chang, Dong-Qing Wei, Xiang-Rong Chen, Qing-Ming Zhang, Zi-Zheng Gong, Guang-Fu Ji, Yong-Xin Guo
    2012-03-01
    28621 3528 Pages:41-48
  • Density Functional Study on the Structural, Frontier Orbital, Electronic, and Magnetic Properties of the Transitional Metal Clusters $Pd_5(CO)_n$ $(n=1$ to $6)$

    Chun-Mei Tang, Hui Wang, Wei-Hua Zhu, Ming-Yi Liu, Ai-Mei Zhang, Jiang-Feng Gong, Hua Zou, Wei Guo
    2013-04-01
    28002 2962 Pages:49-58
  • Accurate Ab Initio Potential Energy Curve of $X^2\Pi$ State and High-Temperature $A^2Δ$-$ X^2\Pi$ Fluorescence Spectra for CH Radical

    Jing Guo, Bing Yan, De-Ling Zeng
    2021-02-23
    27482 2689 Pages:183-192
  • Molecular Theory Investigates the Switching of Mixed Brushes

    Xin-Jun Zhao, Guo-Liang Zhang
    2014-05-01
    28196 2495 Pages:139-147
  • Raman Effect on the Polarization State in Low-Birefringence Fiber

    Si-Yuan Zhang, Wei-Guo Jia, Yu Yu, Mei-Jie Wang, Qing Yan, Hai-Long Qiao
    2021-02-23
    28282 2981 Pages:345-351
  • Semiclassical Diffractive Scattering for Transport Through Open Rectangular Microstructure

    Guo-Peng Zhao, Xiang-Ji Cai, Yan-Hui Zhang, Xiu-Lan Xu, Song Gao
    2015-06-01
    27889 2643 Pages:225-233
  • 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
    28711 2665 Pages:135-145
  • Isolated Attosecond Pulse Generation in a 800 nm Laser Field by Adding a Terahertz (THz) Pulse

    Hui Du, Xin-Lei Ge, Yun-Tao Lin, Hui-Ying Zhong, Jing Guo, Xue-Shen Liu
    2016-07-01
    27711 2852 Pages:146-154
  • Non-Sequential Double Ionization of $CO_2$ Molecule and Kr Atom in Linearly Polarized Laser Fields

    Kaili Song, Yanrong Tian, Shuai Ben, Tongtong Xu, Hongdan Zhang, Xue-Shen Liu, Jing Guo
    2017-08-01
    30682 3346 Pages:1-4
  • High-Order-Harmonic Generation and Ionization from H2 by Time-Dependent Density-Functional Theory

    Shushan Zhou, Jing Guo, Jigen Chen, Yujun Yang
    2017-08-01
    30157 3114 Pages:18-21
  • Theoretical Study on Chemospecificity of CF3SO3CF2CF3 + F− Reactions

    Li Guo, Yulong Xu
    2018-07-10
    26477 2299 Pages:146-151
  • Sulfide Doped Cobalt Oxide Nanosphere as a Highly Efficient Electrocatalyst for Oxygen Evolution Reaction

    Qifei Guo, Yu Han & Rongxing He
    2019-04-09
    59721 4987 Pages:1-3
  • Transport Properties of in-Plane $MoS_2$ Heterostructures from Lateral and Vertical Directions

    Mei Ge, Xiaoyan Guo, Junfeng Zhang
    2016-07-01
    28932 3179 Pages:33-41
1 - 17 of 17 items
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