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Possible molecular bottom-up approach to optical metamaterials

机译:光学超材料的可能的分子自下而上方法

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摘要

We investigate the possibility of a molecular bottom-up approach to the construction of the basic element for optical negative index metamaterials. Undoped and doped graphene-based molecules, including nanotubes, are considered. We employ first-principles and tight-binding electronic structure methods to determine the energy levels and the stability of the molecules. Under certain assumptions, we simulate the electromagnetic response of the molecules by a corresponding network of perfect wires. The nanotubes exhibit a resonant response at the soft x-ray range.
机译:我们研究了分子自下而上的方法来构建光学负折射率超材料的基本元素的可能性。考虑了未掺杂和掺杂的基于石墨烯的分子,包括纳米管。我们采用第一性原理和紧密结合的电子结构方法来确定分子的能级和稳定性。在某些假设下,我们通过相应的理想导线网络模拟分子的电磁响应。纳米管在软X射线范围内表现出共振响应。

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  • 来源
    《Physical review 》 |2012年第11期| p.115404.1-115404.13| 共13页
  • 作者单位

    School of Physics, Astronomy, and Computational Sciences, George Mason University, Fairfax, Virginia 22030, USA;

    School of Physics, Astronomy, and Computational Sciences, George Mason University, Fairfax, Virginia 22030, USA,Foundation for Research and Technology Hellas, P.O. Box 1385, 71110 Heraklion, Crete, and University of Crete, Greece;

    School of Physics, Astronomy, and Computational Sciences, George Mason University, Fairfax, Virginia 22030, USA;

    Center for Computational Materials Science, Naval Research Laboratory, Washington, District of Columbia 20375, USA;

    Center for Computational Materials Science, Naval Research Laboratory, Washington, District of Columbia 20375, USA;

    Foundation for Research and Technology Hellas, P.O. Box 1385, 71110 Heraklion, Crete, and University of Crete, Greece;

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  • 原文格式 PDF
  • 正文语种 eng
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  • 关键词

    wave propagation, transmission and absorption; total energy and cohesive energy calculations;

    机译:波的传播;传输和吸收;总能量和内聚能计算;

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