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  • Nitrogen and Hydrogen Adsorption on the Pyrite ${\rm FeS}_2$ (100) Surface: First-Principles Study

    Xiaolong Hu, Rulin Sun, Yi Cheng, Li Yao, Li Che & Kun Yang
    2018-10-09
    25755 2101 Pages:78-85
  • First-Principles Study on the Cubic CaSiO3 (001) Surface

    Kun Yang, Li Yao, Xiao‐Zhen Wang, Zhuo Feng, Li Li
    2014-02-01
    25979 1887 Pages:101-107
  • The Study of Singlet Biradical Character of the Benzene-Linked Bisphenalenyl Molecule and the Anthracene-Linked Bisphenalenyl Molecule

    Jing Liu, Peng Song, Yong Ding, Shunhuai Yao & Fengcai Ma
    2013-01-01
    25601 1805 Pages:297-306
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