Search results
- 1.0505512 - ÚOCHB 2020 RIV GB eng J - Journal Article
Lee, M. T. - Orlando, F. - Khabiri, Morteza - Roeselová, Martina - Brown, M. A. - Ammann, M.
The opposing effect of butanol and butyric acid on the abundance of bromide and iodide at the aqueous solution-air interface.
Physical Chemistry Chemical Physics. Roč. 21, č. 16 (2019), s. 8418-8427. ISSN 1463-9076. E-ISSN 1463-9084
Institutional support: RVO:61388963
Keywords : liquid-vapor interface * X-ray absorption * surface tension
OECD category: Physical chemistry
Impact factor: 3.430, year: 2019
Method of publishing: Open access
https://pubs.rsc.org/en/content/articlelanding/2019/CP/C8CP07448H#!divAbstract
Permanent Link: http://hdl.handle.net/11104/0296992 - 2.0490978 - ÚOCHB 2019 RIV US eng J - Journal Article
Kong, X. - Toubin, C. - Habartová, Alena - Pluhařová, Eva - Roeselová, Martina - Pettersson, J. B. C.
Rapid Water Transport through Organic Layers on Ice.
Journal of Physical Chemistry A. Roč. 122, č. 21 (2018), s. 4861-4868. ISSN 1089-5639. E-ISSN 1520-5215
Institutional support: RVO:61388963
Keywords : molecular dynamics simulations * supercooled sulfuric acid * particle mesh Ewald
OECD category: Physical chemistry
Impact factor: 2.641, year: 2018
Permanent Link: http://hdl.handle.net/11104/0285074 - 3.0468645 - ÚFCH JH 2017 RIV NL eng J - Journal Article
Olžyńska, Agnieszka - Zubek, M. - Roeselová, Martina - Korchowiec, J. - Cwiklik, Lukasz
Mixed DPPC/POPC Monolayers: All-atom Molecular Dynamics Simulations and Langmuir Monolayer Experiments.
Biochimica Et Biophysica Acta-Biomembranes. Roč. 1858, č. 12 (2016), s. 3120-3130. ISSN 0005-2736. E-ISSN 1879-2642
R&D Projects: GA ČR GA15-14292S
Institutional support: RVO:61388955 ; RVO:61388963
Keywords : phospholipid monolayers * Lung surfactant * molecular dynamics
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 3.498, year: 2016
Method of publishing: Open access
Permanent Link: http://hdl.handle.net/11104/0266455File Download Size Commentary Version Access 0468645.pdf 1 1.6 MB open access Publisher’s postprint open-access - 4.0468642 - ÚFCH JH 2017 RIV US eng J - Journal Article
Perkins, R.J. - Kukharchuk, Alexandra - Delcroix, Pauline - Shoemaker, R. K. - Roeselová, Martina - Cwiklik, Lukasz - Vaida, V.
The Partitioning of Small Aromatic Molecules to Air-Water and Phospholipid Interfaces Mediated by Non-Hydrophobic Interactions.
Journal of Physical Chemistry B. Roč. 120, č. 30 (2016), s. 7408-7422. ISSN 1520-6106. E-ISSN 1520-5207
R&D Projects: GA ČR GA15-14292S
Institutional support: RVO:61388955 ; RVO:61388963
Keywords : Nuclear magnetic resonance spectroscopy * Biological systems * Mass spectrometry
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 3.177, year: 2016
Method of publishing: Open access
Permanent Link: http://hdl.handle.net/11104/0266450File Download Size Commentary Version Access 0468642.pdf 1 3.1 MB open access Publisher’s postprint open-access - 5.0453441 - ÚOCHB 2016 RIV US eng J - Journal Article
Habartová, Alena - Roeselová, Martina - Cwiklik, Lukasz
Investigation of Mixed Surfactant Films at Water Surface Using Molecular Dynamics Simulations.
Langmuir. Roč. 31, č. 42 (2015), s. 11508-11515. ISSN 0743-7463
R&D Projects: GA ČR GA13-06181S
Institutional support: RVO:61388963 ; RVO:61388955
Keywords : Langmuir monolayers * acid monolayers * potentials
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 3.993, year: 2015
Permanent Link: http://hdl.handle.net/11104/0254253File Download Size Commentary Version Access 0453441.pdf 3 9.4 MB Publisher’s postprint require - 6.0450303 - ÚOCHB 2016 RIV US eng J - Journal Article
Habartová, Alena - Hormain, L. - Pluhařová, Eva - Briquez, S. - Monnerville, M. - Toubin, C. - Roeselová, Martina
Molecular Simulations of Halomethanes at the Air/Ice Interface.
Journal of Physical Chemistry A. Roč. 119, č. 39 (2015), s. 10052-10059. ISSN 1089-5639. E-ISSN 1520-5215
R&D Projects: GA ČR GA13-06181S
Institutional support: RVO:61388963
Keywords : molecular dynamics simulations * water models * ice
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 2.883, year: 2015
Permanent Link: http://hdl.handle.net/11104/0251725 - 7.0449079 - ÚOCHB 2016 RIV GB eng J - Journal Article
Gladich, I. - Oswald, A. - Bowens, N. - Naatz, S. - Rowe, P. - Roeselová, Martina - Neshyba, S.
Mechanism of anisotropic surface self-diffusivity at the prismatic ice-vapor interface.
Physical Chemistry Chemical Physics. Roč. 17, č. 35 (2015), s. 22947-22958. ISSN 1463-9076. E-ISSN 1463-9084
R&D Projects: GA ČR GA13-06181S
Institutional support: RVO:61388963
Keywords : molecular dynamics simulations * water models * melting point
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 4.449, year: 2015
Permanent Link: http://hdl.handle.net/11104/0250710 - 8.0446772 - ÚFCH JH 2016 RIV US eng J - Journal Article
Griffith, E. C. - Perkins, R.J. - Telesford, D.-M. - Adams, E. M. - Cwiklik, Lukasz - Allen, H. C. - Roeselová, Martina - Vaida, V.
Interaction of L-Phenylalanine with a Phospholipid Monolayer at the Water−Air Interface.
Journal of Physical Chemistry B. Roč. 119, č. 29 (2015), s. 9038-9048. ISSN 1520-6106. E-ISSN 1520-5207
R&D Projects: GA ČR GA13-06181S
Institutional support: RVO:61388955 ; RVO:61388963
Keywords : SUM-FREQUENCY GENERATION * BREWSTER-ANGLE MICROSCOPY * INTRINSICALLY UNSTRUCTURED PROTEINS
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 3.187, year: 2015
Permanent Link: http://hdl.handle.net/11104/0248742 - 9.0446583 - ÚFCH JH 2016 RIV US eng J - Journal Article
Pysanenko, Andriy - Habartová, Alena - Svrčková, Pavla - Lengyel, Jozef - Poterya, Viktoriya - Roeselová, Martina - Fedor, Juraj - Fárník, Michal
Lack of Aggregation of Molecules on Ice Nanoparticles.
Journal of Physical Chemistry A. Roč. 119, č. 34 (2015), s. 8991-8999. ISSN 1089-5639. E-ISSN 1520-5215
R&D Projects: GA ČR(CZ) GA15-12386S; GA ČR GA13-06181S
Institutional support: RVO:61388955 ; RVO:61388963
Keywords : LARGE WATER CLUSTERS * INFRARED-SPECTROSCOPY * DYNAMICS SIMULATIONS
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 2.883, year: 2015
Permanent Link: http://hdl.handle.net/11104/0248563 - 10.0432612 - ÚOCHB 2015 RIV US eng J - Journal Article
Kania, R. - Malongwe, J. K. - Nachtigallová, Dana - Krousko, J. - Gladich, I. - Roeselová, Martina - Heger, D. - Klán, P.
Spectroscopic Properties of Benzene at the Air-Ice Interface: A Combined Experimental-Computational Approach.
Journal of Physical Chemistry A. Roč. 118, č. 35 (2014), s. 7535-7547. ISSN 1089-5639. E-ISSN 1520-5215
R&D Projects: GA ČR GAP208/12/1318; GA ČR(CZ) GAP208/10/1724; GA MŠMT(CZ) LH11021
Grant - others:GA ČR(CZ) GAP503/10/0947; GA MŠk(CZ) LO1214; European Social Fund(XE) CZ.1.07/2.3.00/30.0037
Institutional support: RVO:61388963
Keywords : density functional theory * polycyclic aromatic hydrocarbons * atmospheric air/ice interfaces
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 2.693, year: 2014
Permanent Link: http://hdl.handle.net/11104/0237067