利用泰勒展式的一级近似,得到了缺陷模频率的解析表达式,进而得到紧束缚理论中的耦合因子。
Under the first-order approximation of Taylor expansion, the analytic expression for the defect mode frequency is derived, from which the coupling factor is deduced.
本文用紧束缚模型和单电子理论研究吸附原子间的间接相互作用能。
The indirect interaction between adatoms are studied by using tight-binding model and one-electron theory.
采用紧束缚能带理论,利用所提出的考虑卷曲效应的紧束缚能量哈密顿量,建立了公度双壁碳纳米管(DWNT)的能带结构模型;
The band structure model of commensurate double-walled carbon nanotube (DWNT) was built by using tight-binding Hamiltonian with curvature effect included.
采用紧束缚能带理论,利用所提出的考虑卷曲效应的紧束缚能量哈密顿量,建立了公度双壁碳纳米管(DWNT)的能带结构模型;
The band structure model of commensurate double-walled carbon nanotube (DWNT) was built by using tight-binding Hamiltonian with curvature effect included.
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