Search results
- 1.0456051 - ÚOCHB 2016 US eng J - Journal Article
Jungwirth, Pavel - Tobias, D. J.
A comment on "pH and the surface tension of water" (J. K. Beattie, A. M. Djerdjev, A. Gray-Weale, N. Kallay, J. Lutzenkirchen, T. Preocanin, A. Selmani, J. Colloid Interface Sci. 422 (2014) 54.).
Journal of Colloid and Interface Science. Roč. 448, Jun 15 (2015), s. 593. ISSN 0021-9797. E-ISSN 1095-7103
Institutional support: RVO:61388963
Keywords : surface tension * Gibbs adsorption equation * hydroxide * water
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 3.782, year: 2015
Permanent Link: http://hdl.handle.net/11104/0256624 - 2.0427644 - ÚOCHB 2015 RIV GB eng J - Journal Article
Nishino, N. - Hollingsworth, S. A. - Stern, A. C. - Roeselová, Martina - Tobias, D. J. - Finlayson-Pitts, B. J.
Interactions of gaseous HNO3 and water with individual and mixed alkyl self-assembled monolayers at room temperature.
Physical Chemistry Chemical Physics. Roč. 16, č. 6 (2014), s. 2358-2367. ISSN 1463-9076. E-ISSN 1463-9084
R&D Projects: GA MŠMT ME09064
Institutional support: RVO:61388963
Keywords : organic surface * molecular dynamics * nitric acid deprotonation
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 4.493, year: 2014
Permanent Link: http://hdl.handle.net/11104/0233165 - 3.0347200 - ÚOCHB 2011 RIV US eng J - Journal Article
Callahan, K. M. - Casillas-Ituarte, N. N. - Xu, M. - Roeselová, Martina - Allen, H. C. - Tobias, D. J.
Effect of Magnesium Cation on the Interfacial Properties of Aqueous Salt Solutions.
Journal of Physical Chemistry A. Roč. 114, č. 32 (2010), s. 8359-8368. ISSN 1089-5639. E-ISSN 1520-5215
R&D Projects: GA MŠMT LC512; GA MŠMT ME09064; GA MŠMT 1P05ME798
Grant - others:NSF(US) CHE-0749807
Institutional research plan: CEZ:AV0Z40550506
Keywords : magnesium cation * chloride ion * interface * molecular dynamics * sum frequency
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 2.732, year: 2010
Permanent Link: http://hdl.handle.net/11104/0006013 - 4.0342608 - ÚOCHB 2011 RIV US eng J - Journal Article
Casillas-Ituarte, N. N. - Callahan, K. M. - Tang, CH. Y. - Chen, X. - Roeselová, Martina - Tobias, D. J. - Allen, H. C.
Surface organization of aqueous MgCl2 and application to atmospheric marine aerosol chemistry.
Proceedings of the National Academy of Sciences of the United States of America. Roč. 107, č. 15 (2010), s. 6616-6621. ISSN 0027-8424. E-ISSN 1091-6490
R&D Projects: GA MŠMT LC512; GA MŠMT ME09064
Institutional research plan: CEZ:AV0Z40550506
Keywords : magnesium chloride * fatty acid * air/aqueous interface
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 9.771, year: 2010
Permanent Link: http://hdl.handle.net/11104/0185299 - 5.0342594 - ÚOCHB 2011 RIV US eng J - Journal Article
Callahan, K. M. - Casillas-Ituarte, N. N. - Roeselová, Martina - Allen, H. C. - Tobias, D. J.
Solvation of Magnesium Dication: Molecular Dynamics Simulation and Vibrational Spectroscopic Study of Magnesium Chloride in Aqueous Solutions.
Journal of Physical Chemistry A. Roč. 114, č. 15 (2010), s. 5141-5148. ISSN 1089-5639. E-ISSN 1520-5215
R&D Projects: GA MŠMT LC512; GA MŠMT ME09064
Institutional research plan: CEZ:AV0Z40550506
Keywords : potential of mean force * ion pairing
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 2.732, year: 2010
Permanent Link: http://hdl.handle.net/11104/0005874 - 6.0342483 - ÚOCHB 2011 RIV US eng J - Journal Article
Heyda, Jan - Vincent, J. C. - Tobias, D. J. - Dzubiella, J. - Jungwirth, Pavel
Ion Specificity at the Peptide Bond: Molecular Dynamics Simulations of N-Methylacetamide in Aqueous Salt Solutions.
Journal of Physical Chemistry B. Roč. 114, č. 2 (2010), s. 1213-1220. ISSN 1520-6106. E-ISSN 1520-5207
R&D Projects: GA ČR GA203/08/0114; GA MŠMT LC512
Grant - others:NSF(US) CHE-0431312; NSF(US) CHE-0209719
Institutional research plan: CEZ:AV0Z40550506
Keywords : molecular dynamics * ion specificity * peptide bond
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 3.603, year: 2010
Permanent Link: http://hdl.handle.net/11104/0005869 - 7.0324729 - ÚOCHB 2009 RIV US eng J - Journal Article
Moussa, S. G. - McIntire, T. M. - Szöri, Milan - Roeselová, Martina - Tobias, D. J. - Grimm, R. L. - Hemminger, J. C. - Finlayson-Pitts, B. J.
Experimental and theoretical characterization of adsorbed water on self-assembled monolayers: Understanding the interaction of water with atmospherically relevant surfaces.
[Experimentální a teoretická charakterizace adsorbované vody na samouspořádaných monovrstvách: Porozumění interakci vody s atmosféricky relevantními povrchy.]
Journal of Physical Chemistry A. Roč. 113, č. 10 (2009), s. 2060-2069. ISSN 1089-5639. E-ISSN 1520-5215
R&D Projects: GA ČR GA203/06/1488; GA MŠMT LC512; GA MŠMT 1P05ME798
Grant - others:NSF(US) 0431312
Institutional research plan: CEZ:AV0Z40550506
Keywords : molecular dynamics * hydrophobic * hydrophilic
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 2.899, year: 2009
Permanent Link: http://hdl.handle.net/11104/0005202 - 8.0324676 - ÚOCHB 2009 RIV US eng J - Journal Article
Szöri, Milan - Tobias, D. J. - Roeselová, Martina
Microscopic wetting of mixed self-assembled monolayers: A molecular dynamics study.
[Mikroskopické smáčení smíšených samouspořádaných monovrstev: Studium pomocí molekulové dynamiky.]
Journal of Physical Chemistry B. Roč. 113, č. 13 (2009), s. 4161-4169. ISSN 1520-6106. E-ISSN 1520-5207
R&D Projects: GA ČR GA203/06/1488; GA MŠMT LC512
Grant - others:NSF(US) CHE-0431312
Institutional research plan: CEZ:AV0Z40550506
Keywords : model organic aerosol surfaces * hydrophobic * hydrophilic
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 3.471, year: 2009
Permanent Link: http://hdl.handle.net/11104/0005199 - 9.0312518 - ÚOCHB 2009 RIV GB eng J - Journal Article
Wingen, L. M. - Moskun, A. C. - Johnson, S. N. - Thomas, J. L. - Roeselová, Martina - Tobias, D. J. - Kleinman, M. T. - Finlayson-Pitts, B. J.
Enhanced surface photochemistry in chloride-nitrate ion mixtures.
[Zvýšená povrchová fotochemie v roztocích obsahujících směsi chloridových a nitrátových iontů.]
Physical Chemistry Chemical Physics. Roč. 10, č. 37 (2008), s. 5668-5677. ISSN 1463-9076. E-ISSN 1463-9084
R&D Projects: GA MŠMT LC512; GA MŠMT 1P05ME798
Grant - others:NSF(US) CHE0431512
Institutional research plan: CEZ:AV0Z40550506
Keywords : aqueous sodium nitrate * air-water interface * molecular dynamics simulation * atmospheric aerosols
Subject RIV: CC - Organic Chemistry
Impact factor: 4.064, year: 2008
Permanent Link: http://hdl.handle.net/11104/0163563 - 10.0181771 - UFCH-W 20030210 RIV US eng J - Journal Article
Roeselová, Martina - Jungwirth, Pavel - Tobias, D. J. - Gerber, R. B.
Impact, Trapping, and Accommodation of Hydroxyl Radical and Ozone at Salt Aerosol Surfaces: A Molecular Dynamics Study.
Journal of Physical Chemistry. B. Roč. 107, - (2003), s. 12690-12699. ISSN 1089-5647
R&D Projects: GA MŠMT LN00A032
Institutional research plan: CEZ:AV0Z4040901
Keywords : impact * ozone * salt aerosol
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 3.679, year: 2003
Permanent Link: http://hdl.handle.net/11104/0078292