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Stripping away ion hydration shells in electrical double-layer formation: Water networks matter.
Alfarano SR, Pezzotti S, Stein CJ, Lin Z, Sebastiani F, Funke S, Hoberg C, Kolling I, Ma CY, Mauelshagen K, Ockelmann T, Schwaab G, Fu L, Brubach JB, Roy P, Head-Gordon M, Tschulik K, Gaigeot MP, Havenith M. Alfarano SR, et al. Among authors: pezzotti s. Proc Natl Acad Sci U S A. 2021 Nov 23;118(47):e2108568118. doi: 10.1073/pnas.2108568118. Proc Natl Acad Sci U S A. 2021. PMID: 34782461 Free PMC article.
2D-HB-Network at the air-water interface: A structural and dynamical characterization by means of ab initio and classical molecular dynamics simulations.
Pezzotti S, Serva A, Gaigeot MP. Pezzotti S, et al. J Chem Phys. 2018 May 7;148(17):174701. doi: 10.1063/1.5018096. J Chem Phys. 2018. PMID: 29739203
Following our previous work where the existence of a special 2-Dimensional H-Bond (2D-HB)-Network was revealed at the air-water interface [S. Pezzotti et al., J. Phys. Chem. Lett. 8, 3133 (2017)], we provide here a full structural and dynamical characterization of t …
Following our previous work where the existence of a special 2-Dimensional H-Bond (2D-HB)-Network was revealed at the air-water interface [ …
Molecular hydrophobicity at a macroscopically hydrophilic surface.
Cyran JD, Donovan MA, Vollmer D, Siro Brigiano F, Pezzotti S, Galimberti DR, Gaigeot MP, Bonn M, Backus EHG. Cyran JD, et al. Among authors: pezzotti s. Proc Natl Acad Sci U S A. 2019 Jan 29;116(5):1520-1525. doi: 10.1073/pnas.1819000116. Epub 2019 Jan 17. Proc Natl Acad Sci U S A. 2019. PMID: 30655339 Free PMC article.
Wrapping Up Hydrophobic Hydration: Locality Matters.
Conti Nibali V, Pezzotti S, Sebastiani F, Galimberti DR, Schwaab G, Heyden M, Gaigeot MP, Havenith M. Conti Nibali V, et al. Among authors: pezzotti s. J Phys Chem Lett. 2020 Jun 18;11(12):4809-4816. doi: 10.1021/acs.jpclett.0c00846. Epub 2020 Jun 5. J Phys Chem Lett. 2020. PMID: 32459100 Free PMC article.
38 results