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中国物理学会期刊

替位式掺杂的富勒烯分子C77X(X=B,N原子)的非线性光学性质

CSTR: 32037.14.aps.48.2042

NONLINEAR OPTICAL PROPERTIES OF THE SUBSTITU-TIONAL FULLERENE C77X(X=B,N ATOMS)

CSTR: 32037.14.aps.48.2042
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  • 采用推广的Su-Schrieffer-Heeger模型和sum-over-state方法计算了掺杂的富勒烯分子C77X(X=B或N原子)的三阶非线性极化率γ.计算结果表明:1)与C78相比,各C77X分子的三阶非线性极化率γ的静态值均有不同程度的提高(3—40倍);2) C77X的非线性动态光学响应不仅与掺杂原子有关,还与异构体种类和掺杂位置有关.

     

    Using the extened Su-Schrieffer-Heeger model and the Sum-Over-State method, we have calculated the third-order nonlinear polarizability γ and its dispersion spectra for single substitutional fullerenes C77X(X=B or N atoms). The results indicate:(1) compared with C78,each of the static values of γ through the substitutional doping increases to some extent (3—40 times);(2) the dynamic nonliear optical reponse of C77X not only depends on doping atoms, but also depends on the substituted isomers and doped sites.

     

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