Hantal G - Search Results

1

Role of Interfaces in Elasticity and Failure of Clay-Organic Nanocomposites: Toughening upon Interface Weakening?

Hantal G, Brochard L, Pellenq RJ, Ulm FJ, Coasne B. Hantal G, et al. Langmuir. 2017 Oct 24;33(42):11457-11466. doi: 10.1021/acs.langmuir.7b01071. Epub 2017 Aug 3. Langmuir. 2017. PMID: 28728412

2

Adsorption of benzaldehyde at the surface of ice, studied by experimental method and computer simulation.

Petitjean M, Hantal G, Chauvin C, Mirabel P, Le Calvé S, Hoang PN, Picaud S, Jedlovszky P. Petitjean M, et al. Among authors: hantal g. Langmuir. 2010 Jun 15;26(12):9596-606. doi: 10.1021/la100169h. Langmuir. 2010. PMID: 20329716

3

Investigation of the adsorption behaviour of acetone at the surface of ice. A grand canonical Monte Carlo simulation study.

Hantal G, Jedlovszky P, Hoang PN, Picaud S. Hantal G, et al. Phys Chem Chem Phys. 2008 Nov 14;10(42):6369-80. doi: 10.1039/b808466a. Epub 2008 Sep 8. Phys Chem Chem Phys. 2008. PMID: 18972025

4

Properties of the liquid-vapor interface of acetone-methanol mixtures, as seen from computer simulation and ITIM surface analysis.

Idrissi A, Hantal G, Jedlovszky P. Idrissi A, et al. Among authors: hantal g. Phys Chem Chem Phys. 2015 Apr 14;17(14):8913-26. doi: 10.1039/c4cp05974c. Epub 2015 Mar 6. Phys Chem Chem Phys. 2015. PMID: 25746419

5

Adsorption of Methylamine on Amorphous Ice under Interstellar Conditions. A Grand Canonical Monte Carlo Simulation Study.

Horváth RA, Hantal G, Picaud S, Szőri M, Jedlovszky P. Horváth RA, et al. Among authors: hantal g. J Phys Chem A. 2018 Apr 5;122(13):3398-3412. doi: 10.1021/acs.jpca.8b01591. Epub 2018 Mar 23. J Phys Chem A. 2018. PMID: 29537265

6

Water adsorption isotherms on porous onionlike carbonaceous particles. Simulations with the grand canonical Monte Carlo method.

Hantal G, Picaud S, Hoang PN, Voloshin VP, Medvedev NN, Jedlovszky P. Hantal G, et al. J Chem Phys. 2010 Oct 14;133(14):144702. doi: 10.1063/1.3496466. J Chem Phys. 2010. PMID: 20950025

7

Counterion and surface density dependence of the adsorption layer of ionic surfactants at the vapor-aqueous solution interface: a computer simulation study.

Hantal G, Partay LB, Varga I, Jedlovszky P, Gilányi T. Hantal G, et al. J Phys Chem B. 2007 Feb 22;111(7):1769-74. doi: 10.1021/jp066969c. Epub 2007 Jan 31. J Phys Chem B. 2007. PMID: 17263573

8

Molecular level properties of the free water surface and different organic liquid/water interfaces, as seen from ITIM analysis of computer simulation results.

Hantal G, Darvas M, Pártay LB, Horvai G, Jedlovszky P. Hantal G, et al. J Phys Condens Matter. 2010 Jul 21;22(28):284112. doi: 10.1088/0953-8984/22/28/284112. Epub 2010 Jun 21. J Phys Condens Matter. 2010. PMID: 21399284

9

A new method for determining the interfacial molecules and characterizing the surface roughness in computer simulations. Application to the liquid-vapor interface of water.

Pártay LB, Hantal G, Jedlovszky P, Vincze A, Horvai G. Pártay LB, et al. Among authors: hantal g. J Comput Chem. 2008 Apr 30;29(6):945-56. doi: 10.1002/jcc.20852. J Comput Chem. 2008. PMID: 17963228

10

Pytim: A python package for the interfacial analysis of molecular simulations.

Sega M, Hantal G, Fábián B, Jedlovszky P. Sega M, et al. Among authors: hantal g. J Comput Chem. 2018 Sep 30;39(25):2118-2125. doi: 10.1002/jcc.25384. Epub 2018 Oct 10. J Comput Chem. 2018. PMID: 30306571 Free PMC article.

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