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Molecular excitation energies to high-lying bound states from timedependent density-functional response thesoty:Characterization and correction of the time-dependent local density approximation ionization threshold 期刊论文
Journal of the Chemical ohysics, 1998, 卷号: 108, 期号: 11, 页码: 4439-4450
Mark E. Casida; Christine Jamorski; Kim C. Casida; and Dennis R. Salahub
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