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  1. Article

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    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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