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Redox Potentials with COSMO-RS: Systematic Benchmarking with Different Databases
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SYSNO 0568172 Title Redox Potentials with COSMO-RS: Systematic Benchmarking with Different Databases Author(s) Tomaník, L. (CZ)
Rulíšek, Lubomír (UOCHB-X) [640/64] RID, ORCID
Slavíček, P. (CZ)Corespondence/senior Slavíček, P. - Korespondující autor Source Title Journal of Chemical Theory and Computation . Roč. 19, č. 3 (2023), s. 1014-1022. - : American Chemical Society Document Type Článek v odborném periodiku Institutional support UOCHB-X - RVO:61388963 Language eng Country US Keywords solvation free energies * computational electrochemistry * reduction potentials Cooperating institutions Vysoká škola chemicko-technologická v Praze (Czech Republic) URL https://doi.org/10.1021/acs.jctc.2c00919 Permanent Link https://hdl.handle.net/11104/0339508
Number of the records: 1