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Energetic Origin of Proton Affinity to the Air/Water Interface
- 1.0359736 - ÚOCHB 2012 RIV US eng J - Journal Article
Takahashi, H. - Maruyama, K. - Karino, Y. - Morita, A. - Nakano, M. - Jungwirth, Pavel - Matubayasi, N.
Energetic Origin of Proton Affinity to the Air/Water Interface.
Journal of Physical Chemistry B. Roč. 115, č. 16 (2011), s. 4745-4751. ISSN 1520-6106. E-ISSN 1520-5207
R&D Projects: GA ČR GA203/08/0114; GA MŠMT LC512
Institutional research plan: CEZ:AV0Z40550506
Keywords : hydronium * water surface * molecular dynamics
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 3.696, year: 2011
To investigate the mechanism responsible for the surface propensity of hydronium, we performed a series of novel quantum chemical simulations combined with the theory of solutions.
Permanent Link: http://hdl.handle.net/11104/0006451
Number of the records: 1