Hernańdez-Cobos J - Search Results

1

Ion hydration in nanopores and the molecular basis of selectivity.

Carrillo-Tripp M, San-Román ML, Hernańdez-Cobos J, Saint-Martin H, Ortega-Blake I. Carrillo-Tripp M, et al. Biophys Chem. 2006 Dec 1;124(3):243-50. doi: 10.1016/j.bpc.2006.04.012. Epub 2006 May 3. Biophys Chem. 2006. PMID: 16765508

2

Water models based on a single potential energy surface and different molecular degrees of freedom.

Saint-Martin H, Hernández-Cobos J, Ortega-Blake I. Saint-Martin H, et al. J Chem Phys. 2005 Jun 8;122(22):224509. doi: 10.1063/1.1931567. J Chem Phys. 2005. PMID: 15974693

3

Water liquid-vapor equilibria predicted by refined ab initio derived potentials.

Hernández-Cobos J, Saint-Martin H, Mackie AD, Vega LF, Ortega-Blake I. Hernández-Cobos J, et al. J Chem Phys. 2005 Jul 22;123(4):044506. doi: 10.1063/1.1950627. J Chem Phys. 2005. PMID: 16095368

4

Liquid methanol Monte Carlo simulations with a refined potential which includes polarizability, nonadditivity, and intramolecular relaxation.

Valdéz-González M, Saint-Martin H, Hernández-Cobos J, Ayala R, Sanchez-Marcos E, Ortega-Blake I. Valdéz-González M, et al. J Chem Phys. 2007 Dec 14;127(22):224507. doi: 10.1063/1.2801538. J Chem Phys. 2007. PMID: 18081406

5

Aqueous solvation of As(OH)3: a Monte Carlo study with flexible polarizable classical interaction potentials.

Hernández-Cobos J, Vargas MC, Ramírez-Solís A, Ortega-Blake I. Hernández-Cobos J, et al. J Chem Phys. 2010 Sep 21;133(11):114501. doi: 10.1063/1.3483619. J Chem Phys. 2010. PMID: 20866139

6

A refined potential for hydroxylamine clusters and the liquid phase.

González-Espinoza A, Hernández-Cobos J, Ortega-Blake I. González-Espinoza A, et al. J Chem Phys. 2011 Aug 7;135(5):054502. doi: 10.1063/1.3610344. J Chem Phys. 2011. PMID: 21823707

7

Interpretation of X-ray absorption spectra of As(III) in solution using Monte Carlo simulations.

Canche-Tello J, Vargas MC, Hérnandez-Cobos J, Ortega-Blake I, Leclercq A, Solari PL, Den Auwer C, Mustre de Leon J. Canche-Tello J, et al. J Phys Chem A. 2014 Nov 20;118(46):10967-73. doi: 10.1021/jp5061232. Epub 2014 Nov 7. J Phys Chem A. 2014. PMID: 25340994

8

X-ray accelerated photo-oxidation of As(III) in solution.

Canche-Tello J, Vargas MC, Hérnandez-Cobos J, Ortega-Blake I, Leclercq A, Solari PL, Lezama-Pacheco J, Den Auwer C, de Leon JM. Canche-Tello J, et al. J Phys Chem A. 2015 Mar 26;119(12):2829-33. doi: 10.1021/jp510596p. Epub 2015 Mar 17. J Phys Chem A. 2015. PMID: 25730736

9

Aqueous solvation of Mg(ii) and Ca(ii): A Born-Oppenheimer molecular dynamics study of microhydrated gas phase clusters.

León-Pimentel CI, Amaro-Estrada JI, Hernández-Cobos J, Saint-Martin H, Ramírez-Solís A. León-Pimentel CI, et al. Among authors: hernandez cobos j. J Chem Phys. 2018 Apr 14;148(14):144307. doi: 10.1063/1.5021348. J Chem Phys. 2018. PMID: 29655339

10

On the aqueous solvation of AsO(OH)₃vs. As(OH)₃. Born-Oppenheimer molecular dynamics density functional theory cluster studies.

Ramírez-Solís A , Amaro-Estrada JI , León-Pimentel CI , Hernández-Cobos J , Garrido-Hoyos SE , Saint-Martin H . Ramírez-Solís A , et al. Among authors: hernandez cobos j. Phys Chem Chem Phys. 2018 Jun 20;20(24):16568-16578. doi: 10.1039/c8cp01673a. Phys Chem Chem Phys. 2018. PMID: 29873361

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