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Predicting Excitation Energies of Twisted Intramolecular Charge-Transfer States with Time-Dependent Density Functional Theory: Comparison with Experimental Measurements in the Gas-Phase and Solvents Ranging from Hexanes to Acetonitrile

机译：用时间依赖性密度函数理论预测扭曲分子内电荷传递态的激发能量：与己烷至乙腈的气相和溶剂的实验测量比较

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James Shee; Martin Head-Gordon;
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7. Predicting Excitation Energies of Twisted Intramolecular Charge-Transfer States with Time-Dependent Density Functional Theory: Comparison with Experimental Measurements in the Gas-Phase and Solvents Ranging from Hexanes to Acetonitrile [O] . James Shee, Martin Head-Gordon 2020

机译：用时间依赖性密度函数理论预测扭曲分子内电荷传递态的激发能量：与己烷至乙腈的气相和溶剂的实验测量比较

Predicting Excitation Energies of Twisted Intramolecular Charge-Transfer States with Time-Dependent Density Functional Theory: Comparison with Experimental Measurements in the Gas-Phase and Solvents Ranging from Hexanes to Acetonitrile

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