• At PM3/CIS level, the vertical excitation spectra were calculated and the vertical excitation energies and corresponding oscillator strength from the ground states to the excited states are obtained.

    PM3/CIS水平计算了它们电子光谱得到了基态激发态垂直跃迁能相应振子强度

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  • The oscillator strength and radiation rates are also calculated.

    计算了相关态的强度辐射跃迁率

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  • The oscillator strength and radiation rates are also calculated.

    计算了相关态的强度辐射跃迁率

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