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Parishna Dutta

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Range‐Separated Density Functionals in Predicting Correct Excitation Energies in Gas and Solvent Continuum: A Benchmark Investigation on a Large Set of Molecules

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By Satter Rohman, Rahul Kar, Parishna Dutta
| Wiley Online Library Verified
Supporting Information Filename Description qua70030-sup-0001-Tables.docxWord 2007 document , 105.4 KB DATA S1. Supplementary Tables. References 1, , , , and , “State-Specific Coupled-Cluster Methods for Excited States,” Journal of Chemical Theory and Computation 20 (2024): 4129–4145. 2 and , “A Mountaineering Strategy to Excited States: Accurate Vertical Transition Energies and Benchmarks for Substituted Benzenes,” Journal of Computational Chemistry 45 (2024): 1791–1805.
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