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Metal-insulator transition in quasi-one-dimensional HfTe_3 in the few-chain limit

机译:在几个链限制中,金属绝缘体在准一维HFTE_3中转换

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摘要

The quasi-one-dimensional linear chain compound HfTe3 is experimentally and theoretically explored in the few- to single-chain limit. Confining the material within the hollow core of carbon nanotubes allows isolation of the chains and prevents the rapid oxidation which plagues even bulk HfTe3. High-resolution transmission electron microscopy combined with density functional theory calculations reveals that, once the triple-chain limit is reached, the normally parallel chains spiral about each other, and simultaneously a short-wavelength trigonal antiprismatic rocking distortion occurs that opens a significant energy gap. This results in a size-driven metal-insulator transition.
机译:准一维线性链复合HFTe3在实验和理论上探讨了几个至单链限制。将碳纳米管的中空核心内的材料限制允许分离链并防止悬浮甚至散毛3的快速氧化。高分辨率透射电子显微镜结合密度函数理论计算揭示了,一旦达到三链限制,就彼此螺旋螺旋螺旋,并且同时发生短波长度的三角形抗反抗变形,从而打开显着的能量隙。这导致尺寸驱动的金属绝缘体过渡。

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  • 来源
    《Physical review》 |2019年第4期|041403.1-041403.5|共5页
  • 作者单位

    Univ Calif Berkeley Dept Phys Berkeley CA 94720 USA|Univ Calif Berkeley Dept Chem Berkeley CA 94720 USA|Univ Calif Berkeley Kavli Energy NanoSci Inst Berkeley CA 94720 USA|Lawrence Berkeley Natl Lab Mat Sci Div Berkeley CA 94720 USA;

    Univ Calif Berkeley Dept Phys Berkeley CA 94720 USA|Univ Calif Berkeley Kavli Energy NanoSci Inst Berkeley CA 94720 USA|Lawrence Berkeley Natl Lab Mat Sci Div Berkeley CA 94720 USA|Univ Calif Berkeley Dept Mat Sci & Engn Berkeley CA 94720 USA;

    Univ Calif Berkeley Dept Phys Berkeley CA 94720 USA|Lawrence Berkeley Natl Lab Mat Sci Div Berkeley CA 94720 USA;

    Mol Foundry One Cyclotron Rd Berkeley CA 94720 USA;

    Mol Foundry One Cyclotron Rd Berkeley CA 94720 USA;

    Univ Calif Berkeley Dept Phys Berkeley CA 94720 USA|Lawrence Berkeley Natl Lab Mat Sci Div Berkeley CA 94720 USA;

    Univ Calif Berkeley Dept Phys Berkeley CA 94720 USA|Univ Calif Berkeley Kavli Energy NanoSci Inst Berkeley CA 94720 USA|Lawrence Berkeley Natl Lab Mat Sci Div Berkeley CA 94720 USA;

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