Vega C - Search Results

1

Further extension of the Madrid-2019 force field: Parametrization of nitrate (NO3-) and ammonium (NH4+) ions.

Trejos VM, de Lucas M, Vega C, Blazquez S, Gámez F. Trejos VM, et al. Among authors: vega c. J Chem Phys. 2023 Dec 14;159(22):224501. doi: 10.1063/5.0177363. J Chem Phys. 2023. PMID: 38063225

2

Combinatorial entropy and phase diagram of partially ordered ice phases.

Macdowell LG, Sanz E, Vega C, Abascal JL. Macdowell LG, et al. Among authors: vega c. J Chem Phys. 2004 Nov 22;121(20):10145-58. doi: 10.1063/1.1808693. J Chem Phys. 2004. PMID: 15549889

3

The melting temperature of the most common models of water.

Vega C, Sanz E, Abascal JL. Vega C, et al. J Chem Phys. 2005 Mar 15;122(11):114507. doi: 10.1063/1.1862245. J Chem Phys. 2005. PMID: 15836229

Since the melting temperature of ice I(h) for the TIP4P model is now known [E. Sanz, C. Vega, J. L. F. Abascal, and L. G. MacDowell, Phys. Rev. Lett. 92, 255701 (2004)], it is possible to use the Gibbs-Duhem methodology [D. ...

Since the melting temperature of ice I(h) for the TIP4P model is now known [E. Sanz, C. Vega, J. L. F. Abascal, and L. G. MacD …

4

A potential model for the study of ices and amorphous water: TIP4P/Ice.

Abascal JL, Sanz E, García Fernández R, Vega C. Abascal JL, et al. Among authors: vega c. J Chem Phys. 2005 Jun 15;122(23):234511. doi: 10.1063/1.1931662. J Chem Phys. 2005. PMID: 16008466

5

Relation between the melting temperature and the temperature of maximum density for the most common models of water.

Vega C, Abascal JL. Vega C, et al. J Chem Phys. 2005 Oct 8;123(14):144504. doi: 10.1063/1.2056539. J Chem Phys. 2005. PMID: 16238404

6

A general purpose model for the condensed phases of water: TIP4P/2005.

Abascal JL, Vega C. Abascal JL, et al. Among authors: vega c. J Chem Phys. 2005 Dec 15;123(23):234505. doi: 10.1063/1.2121687. J Chem Phys. 2005. PMID: 16392929

7

The melting point of ice Ih for common water models calculated from direct coexistence of the solid-liquid interface.

García Fernández R, Abascal JL, Vega C. García Fernández R, et al. Among authors: vega c. J Chem Phys. 2006 Apr 14;124(14):144506. doi: 10.1063/1.2183308. J Chem Phys. 2006. PMID: 16626213

8

Vapor-liquid equilibria from the triple point up to the critical point for the new generation of TIP4P-like models: TIP4P/Ew, TIP4P/2005, and TIP4P/ice.

Vega C, Abascal JL, Nezbeda I. Vega C, et al. J Chem Phys. 2006 Jul 21;125(3):34503. doi: 10.1063/1.2215612. J Chem Phys. 2006. PMID: 16863358

9

Solubility of KF and NaCl in water by molecular simulation.

Sanz E, Vega C. Sanz E, et al. Among authors: vega c. J Chem Phys. 2007 Jan 7;126(1):014507. doi: 10.1063/1.2397683. J Chem Phys. 2007. PMID: 17212500

10

Surface tension of the most popular models of water by using the test-area simulation method.

Vega C, de Miguel E. Vega C, et al. J Chem Phys. 2007 Apr 21;126(15):154707. doi: 10.1063/1.2715577. J Chem Phys. 2007. PMID: 17461659 Free article.

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