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Theoretical and Computational Chemistry

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Abhilash Patra

2 results in Authors: Abhilash Patra

Theoretical and Computational Chemistry

Simulating Excited-State Complex Ensembles: Fluorescence and Solvatochromism in Amine-Arene Exciplexes

Abhilash Patra, Anna Krylov, Shaama Mallikarjun Sharada

Version 1 posted 15 May 2023

302

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Theoretical and Computational Chemistry

Performance of density functionals for excited-state properties of isolated chromophores and exciplexes: Emission spectra, solvatochromic shifts, and charge-transfer character

Abhilash Patra, George Baffour Pipim, Anna I. Krylov, Shaama Mallikarjun Sharada

Version 1 posted 04 January 2024

310

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