Level of Theory and Solvent Effects on DASA Absorption Properties Prediction: Comparing TD-DFT, CASPT2 and NEVPT2 - Archive ouverte HAL
Article Dans Une Revue Materials Année : 2017

Level of Theory and Solvent Effects on DASA Absorption Properties Prediction: Comparing TD-DFT, CASPT2 and NEVPT2

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hal-01772002 , version 1 (20-04-2018)

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Cristina Garcia-Iriepa, Marco Marazzi. Level of Theory and Solvent Effects on DASA Absorption Properties Prediction: Comparing TD-DFT, CASPT2 and NEVPT2. Materials, 2017, 10 (9), ⟨10.3390/ma10091025⟩. ⟨hal-01772002⟩
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