کد مقاله کد نشریه سال انتشار مقاله انگلیسی نسخه تمام متن
5431715 1508822 2017 6 صفحه PDF دانلود رایگان
عنوان انگلیسی مقاله ISI
Interplay between the Kagome flat band and the Dirac cone in porous graphitic networks
ترجمه فارسی عنوان
تعامل بین باند مسطح Kagome و مخروط دیراک در شبکه های گرافیتی متخلخل
موضوعات مرتبط
مهندسی و علوم پایه مهندسی انرژی انرژی (عمومی)
چکیده انگلیسی

We have investigated the geometric and electronic structures of porous graphene consisting of triangular hydrocarbon molecules polymerized by oligoacene interconnects by density functional theory. The networks possess both Dirac cones and Kagome flat bands near the Fermi level of which electron filling is controllable by selecting appropriate oligoacene interconnects because the triangular units and interconnects are arranged in honeycomb and Kagome lattices, respectively. The partially filled Kagome band in the network with the shortest interconnects induces ferromagnetic spin ordering throughout the porous graphitic network with a magnetic moment of 1.00 μB/cell. For networks with longer interconnects, the sheet is a zero gap semiconductor with a Dirac cone at the Fermi level of which band width decreases with increasing length of the interconnect despite the network containing pentagonal rings.

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ناشر
Database: Elsevier - ScienceDirect (ساینس دایرکت)
Journal: Carbon - Volume 125, December 2017, Pages 530-535
نویسندگان
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