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Are DFT Methods Able to Predict Reduction Potentials of Ruthenium Nitrosyl Complexes Accurately?

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Title: Are DFT Methods Able to Predict Reduction Potentials of Ruthenium Nitrosyl Complexes Accurately?
Authors: Coimbra DF; Departamento de Química, Universidade Federal de Santa Catarina, Campus Universitário Trindade, CP 476, Florianópolis, SC 88040-900, Brazil., Cintra CH; Núcleo de Pesquisas em Ciências Exatas e Tecnológicas, Universidade de Franca, Franca, SP, 14404-600 Brazil., Lourenço LCL; Núcleo de Pesquisas em Ciências Exatas e Tecnológicas, Universidade de Franca, Franca, SP, 14404-600 Brazil., Parreira RLT; Núcleo de Pesquisas em Ciências Exatas e Tecnológicas, Universidade de Franca, Franca, SP, 14404-600 Brazil., Orenha RP; Núcleo de Pesquisas em Ciências Exatas e Tecnológicas, Universidade de Franca, Franca, SP, 14404-600 Brazil., Caramori GF; Departamento de Química, Universidade Federal de Santa Catarina, Campus Universitário Trindade, CP 476, Florianópolis, SC 88040-900, Brazil.
Source: The journal of physical chemistry. A [J Phys Chem A] 2020 Jul 30; Vol. 124 (30), pp. 6186-6192. Date of Electronic Publication: 2020 Jul 21.
Publication Type: Journal Article
Journal Info: Publisher: American Chemical Society Country of Publication: United States NLM ID: 9890903 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1520-5215 (Electronic) Linking ISSN: 10895639 NLM ISO Abbreviation: J Phys Chem A Subsets: MEDLINE; PubMed not MEDLINE
Database: MEDLINE Ultimate
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  Data: <searchLink fieldCode="AU" term="%22Coimbra+DF%22">Coimbra DF</searchLink>; Departamento de Química, Universidade Federal de Santa Catarina, Campus Universitário Trindade, CP 476, Florianópolis, SC 88040-900, Brazil.<br /><searchLink fieldCode="AU" term="%22Cintra+CH%22">Cintra CH</searchLink>; Núcleo de Pesquisas em Ciências Exatas e Tecnológicas, Universidade de Franca, Franca, SP, 14404-600 Brazil.<br /><searchLink fieldCode="AU" term="%22Lourenço+LCL%22">Lourenço LCL</searchLink>; Núcleo de Pesquisas em Ciências Exatas e Tecnológicas, Universidade de Franca, Franca, SP, 14404-600 Brazil.<br /><searchLink fieldCode="AU" term="%22Parreira+RLT%22">Parreira RLT</searchLink>; Núcleo de Pesquisas em Ciências Exatas e Tecnológicas, Universidade de Franca, Franca, SP, 14404-600 Brazil.<br /><searchLink fieldCode="AU" term="%22Orenha+RP%22">Orenha RP</searchLink>; Núcleo de Pesquisas em Ciências Exatas e Tecnológicas, Universidade de Franca, Franca, SP, 14404-600 Brazil.<br /><searchLink fieldCode="AU" term="%22Caramori+GF%22">Caramori GF</searchLink>; Departamento de Química, Universidade Federal de Santa Catarina, Campus Universitário Trindade, CP 476, Florianópolis, SC 88040-900, Brazil.
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  Data: <searchLink fieldCode="JN" term="%229890903%22">The journal of physical chemistry. A</searchLink> [J Phys Chem A] 2020 Jul 30; Vol. 124 (30), pp. 6186-6192. <i>Date of Electronic Publication: </i>2020 Jul 21.
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        Value: 10.1021/acs.jpca.0c03718
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      – TitleFull: Are DFT Methods Able to Predict Reduction Potentials of Ruthenium Nitrosyl Complexes Accurately?
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              Text: 2020 Jul 30
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