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    Article

    Exploring the effect of oxygen-containing functional groups on the water-holding capacity of lignite

    Graphene oxide with different degrees of oxidation was prepared and selected as a model compound of lignite to study quantitatively, using both experiment and theoretical calculation methods, the effect on wat...

    Jie Liu, **angang Jiang, Yu Cao, Chen Zhang, Guangyao Zhao in Journal of Molecular Modeling (2018)

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    Article

    Construction of a molecular structure model of mild-oxidized Chinese lignite using Gaussian09 based on data from FTIR, solid state 13C-NMR

    Great progress has been made in the detection of fractions from oxidized lignite, but no molecular structures are reported. A molecular structure model of oxidized Shengli lignite was constructed using ultimat...

    Youzhi Lu, Li Feng, **angang Jiang, Yingya Zhao in Journal of Molecular Modeling (2018)