材料科学
碳纤维
钻石
费米能级
金属
纳米技术
电阻率和电导率
复合材料
复合数
冶金
量子力学
电气工程
物理
工程类
电子
作者
Yinqiao Liu,Xue Jiang,Jie Fu,Jijun Zhao
出处
期刊:Carbon
[Elsevier]
日期:2018-01-01
卷期号:126: 601-610
被引量:32
标识
DOI:10.1016/j.carbon.2017.10.066
摘要
Metallic carbon has received long-standing attentions for its fascinating applications in superconductivity, electronic devices and high-performance anode materials. Here we design two types of metallic carbon phases, namely O-type and T-type carbon, using self-assembling diamond nanostripes as building block and CC bond as linkers. These O-type and T-type allotropes are energetically more favorable than most previously identified three-dimensional (3D) metallic carbon allotropies, while their stability is confirmed by a series of first-principles calculations. Excitingly, these all-carbon crystals not only exhibit ultrahigh Fermi velocity and anisotropic electrical conductivity, but also belong to superhard materials with good mechanical properties. By simulating the X-ray diffraction patterns, we propose that O-type and T-type carbon would be one of the unidentified carbon phases observed in recent detonation experiments or shock-compression of tetracyanoethylene (TCE) powder. The good electrical conductivity, high mechanical strength, tunable electronic properties might find applications in electromechanical systems and nanoelectronic devices.
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