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A TDDFT Approach for Calculating Frequency Dependent Polarizabilities and Excitation Energies with N
[会议论文] 作者:DaolingPeng[1]LiangPeng[1]FengLongGu[1]WeitaoYang[2],
来源:第十三届全国量子化学会议 年份:2017
Time dependent density functional theory(TDDFT)is a useful tool to calculate molecular properties with reasonable computational costs comparing to wave func...
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