Publicaciones en las que colabora con José Manuel García de la Vega (13)

2018

  1. Molecular modeling and physicochemical properties of 1-alkyl-3-methylimidazolium-FeX4 and -Fe2X7 (X = Cl and Br) magnetic ionic liquids

    Journal of Molecular Liquids, Vol. 256, pp. 175-182

2017

  1. The role of errors related to DFT methods in calculations involving ion pairs of ionic liquids

    Journal of Computational Chemistry, Vol. 38, Núm. 8, pp. 530-540

2016

  1. Understanding the Structure and Properties of Cholinium Amino Acid Based Ionic Liquids

    Journal of Physical Chemistry B, Vol. 120, Núm. 39, pp. 10327-10335

2015

  1. Effect of dielectric constant on estimation of properties of ionic liquids: an analysis of 1-alkyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide

    RSC Advances, Vol. 5, Núm. 89, pp. 72709-72715

2014

  1. Alkyl substituent effect on density, viscosity and chemical behavior of 1-alkyl-3-methylimidazolium chloride

    Journal of Molecular Modeling, Vol. 20, Núm. 9, pp. 1-9

  2. Electron density analysis of 1-butyl-3-methylimidazolium chloride ionic liquid

    Journal of Molecular Modeling, Vol. 20, Núm. 6

2013

  1. A mathematical model applied for assisting the estimation of PMI in a case of forensic importance. First record of Conicera similis (Diptera: Phoridae) in a corpse

    Forensic Science International, Vol. 231, Núm. 1-3

  2. Effect of the molecular structure in the prediction of thermodynamic properties for 1-butyl-3-methylimidazolium chloride ionic liquid

    International Journal of Quantum Chemistry, Vol. 113, Núm. 6, pp. 852-858

  3. Electron density deformations provide new insights into the spectral shift of rhodopsins

    Journal of Computational Chemistry, Vol. 34, Núm. 28, pp. 2460-2471

2009

  1. Molecular modeling of porphyrin-based conjugates and subphthalocyanine aggregates

    Journal of Porphyrins and Phthalocyanines, Vol. 13, Núm. 4-5, pp. 494-508

2007

  1. On the molecular electron structure of three phosphinine-containing macrocycles

    Journal of Computational Chemistry, Vol. 28, Núm. 5, pp. 958-966

2003

  1. Polarized basis sets of slater-type orbitals: H to Ne atoms

    Journal of Computational Chemistry, Vol. 24, Núm. 7, pp. 859-868

1985

  1. Atomic partitioning of long-range two-center potentials

    Journal of Molecular Structure: THEOCHEM, Vol. 120, Núm. C, pp. 163-174