Title: | Validation of computational protocols for ions hydration free energy calculations based on efficient quantum chemical methods |
View/Open | CAR0005.00.24_Victoria Miranda.pdf ( 223.58 kB ) |
Author: | Miranda, Victória S. S. Silva, Lucas Andrade Prates, Letícia Maia Pereira, Alexandre Moni Correia, Julio Cesar Guedes |
Keywords: | Solvent energies Hydration of ions Eletrostatic interactions Energia solvente Hidratação de íons Interação eletrostática |
Date of Public.: | 2024 |
Publisher: | XII Congresso Brasileiro de Ternodinâmica , VIII Escola de Termodinâmica |
Appears in Collections: | Trabalhos de Congressos |
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