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Behavior of the Eigen Form of Hydronium at the Air/Water Interface
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SYSNO ASEP 0360476 Document Type J - Journal Article R&D Document Type Journal Article Subsidiary J Článek ve WOS Title Behavior of the Eigen Form of Hydronium at the Air/Water Interface Author(s) Jagoda-Cwiklik, Barbara (UOCHB-X)
Cwiklik, Lukasz (UOCHB-X) RID, ORCID
Jungwirth, Pavel (UOCHB-X) RID, ORCIDNumber of authors 3 Source Title Journal of Physical Chemistry A. - : American Chemical Society - ISSN 1089-5639
Roč. 115, č. 23 (2011), s. 5881-5886Number of pages 6 s. Language eng - English Country US - United States Keywords hydronium ; air/water interface ; molecular dynamics Subject RIV CF - Physical ; Theoretical Chemistry R&D Projects LC512 GA MŠMT - Ministry of Education, Youth and Sports (MEYS) GA203/08/0114 GA ČR - Czech Science Foundation (CSF) CEZ AV0Z40550506 - UOCHB-X (2005-2011) UT WOS 000291338800019 DOI 10.1021/jp110078s Annotation Surface affinity of hydronium is explored using umbrella sampling molecular dynamics simulations with a refined polarizable potential. Workplace Institute of Organic Chemistry and Biochemistry Contact asep@uochb.cas.cz ; Kateřina Šperková, Tel.: 232 002 584 ; Viktorie Chládková, Tel.: 232 002 434 Year of Publishing 2012
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