Publicaciones en colaboración con investigadores/as de University of Milan (7)

2021

  1. Quantum theory of atoms in molecules and the AlMAll software

    Complementary Bonding Analysis (De Gruyter), pp. 43-73

2017

  1. Advanced capabilities for materials modelling with Quantum ESPRESSO

    Journal of Physics Condensed Matter, Vol. 29, Núm. 46

2015

  1. An Interacting Quantum Atoms Analysis of the Metal-Metal Bond in [M2(CO)8]n Systems

    Journal of Physical Chemistry A, Vol. 119, Núm. 10, pp. 2153-2160

  2. Quest for missing proteins: Update 2015 on chromosome-centric human proteome project

    Journal of Proteome Research, Vol. 14, Núm. 9, pp. 3415-3431

2011

  1. Restoring orbital thinking from real space descriptions: Bonding in classical and non-classical transition metal carbonyls

    Physical Chemistry Chemical Physics, Vol. 13, Núm. 11, pp. 5068-5077

2010

  1. Bonding in classical and nonclassical transition metal carbonyls: The interacting quantum atoms perspective

    Journal of Chemical Theory and Computation, Vol. 6, Núm. 4, pp. 1064-1074

2009

  1. Using pseudopotentials within the interacting quantum atoms approach

    Journal of Physical Chemistry A, Vol. 113, Núm. 27, pp. 7963-7971