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  1. Article

    Open Access

    First-principle study of structural, electronic and magnetic properties of (FeC)n (n = 1–8) and (FeC)8TM (TM = V, Cr, Mn and Co) clusters

    The structural, electronic and magnetic properties of the (FeC)n (n = 1–8) clusters are studied using the unbiased CALYPSO structure search method and density functional theory. A combination of the PBE functiona...

    Cheng-Gang Li, Jie Zhang, Wu-Qin Zhang, Ya-Nan Tang, Bao-Zeng Ren… in Scientific Reports (2017)

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  2. Article

    Open Access

    Insights into the structures and electronic properties of Cun+1 μ and CunS μ (n = 1–12; μ = 0, ±1) clusters

    The stability and reactivity of clusters are closely related to their valence electronic configuration. Do** is a most efficient method to modify the electronic configuration and properties of a cluster. Con...

    Cheng-Gang Li, Zi-Gang Shen, Yan-Fei Hu, Ya-Nan Tang, Wei-Guang Chen… in Scientific Reports (2017)

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  3. No Access

    Article

    Promotion of CO oxidation on the Fe/N X clusters embedded graphene

    CO catalytic oxidation on the two-dimensional (2D) Fe/N X clusters embedded graphene (G) (X = 4, 3, 2, 1) with D 4h, C 2v, C ...

    Ming Yu Zhao, Ru Meng Zhao, Meng Meng Niu, Wei Li, Ya Qiang Ma, Yi Li… in Applied Physics A (2017)

  4. No Access

    Article

    Improvement of Expression Level and Bioactivity of Soluble Tumor Necrosis Factor-Related Apoptosis-Inducing Ligand (Apo2L/TRAIL) by a Novel Zinc ion Feeding Strategy

    Tumor necrosis factor (TNF)-related apoptosis-inducing ligand (Apo2L/TRAIL) is a new member of the TNF superfamily. In this work, the key role of Zn2+ in high-level expression of soluble TRAIL was confirmed. The ...

    Ai-You Sun, Ya-Ling Shen, Ji-Cheng Yin, Hong Zhang, Ya-Nan Tang… in Biotechnology Letters (2006)