Search Results - Sepali, Chiara

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  1. 1
    Computational Spectroscopy of Aqueous Solutions: The Underlying Role of Conformational Sampling

    Computational Spectroscopy of Aqueous Solutions: The Underlying Role of Conformational Sampling by Sepali, Chiara, Gómez, Sara, Grifoni, Emanuele, Giovannini, Tommaso, Cappelli, Chiara

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  2. 2
    Fully Polarizable Multiconfigurational Self-Consistent Field/Fluctuating Charges Approach

    Fully Polarizable Multiconfigurational Self-Consistent Field/Fluctuating Charges Approach by Sepali, Chiara, Goletto, Linda, Lafiosca, Piero, Rinaldi, Matteo, Giovannini, Tommaso, Cappelli, Chiara

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  3. 3
    Effective fully polarizable QM/MM approaches to compute Raman and Raman Optical Activity spectra in aqueous solution

    Effective fully polarizable QM/MM approaches to compute Raman and Raman Optical Activity spectra in aqueous solution by Sepali, Chiara, Lafiosca, Piero, Gómez, Sara, Giovannini, Tommaso, Cappelli, Chiara

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  4. 4
    Deciphering the structure of deep eutectic solvents: A computational study from the solute's viewpoint

    Deciphering the structure of deep eutectic solvents: A computational study from the solute's viewpoint by Sepali, Chiara, Skoko, Sulejman, Guglielmero, Luca, Giovannini, Tommaso, Mezzetta, Andrea, D'Andrea, Felicia, Pomelli, Christian Silvio, Guazzelli, Lorenzo, Cappelli, Chiara

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  5. 5
    Fully Polarizable Multiconfigurational Self-consistent Field/Fluctuating Charge Approach

    Fully Polarizable Multiconfigurational Self-consistent Field/Fluctuating Charge Approach by Sepali, Chiara, Goletto, Linda, Lafiosca, Piero, Rinaldi, Matteo, Giovannini, Tommaso, Cappelli, Chiara

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