Publications dans lesquelles il/elle collabore avec Julia Contreras García (17)

2022

  1. Chemical Information

    Conceptual Density Functional Theory: Towards a New Chemical Reactivity Theory: Volume 1 (wiley), pp. 349-374

  2. New venues in electron density analysis

    Physical Chemistry Chemical Physics, Vol. 24, Núm. 36, pp. 21538-21548

2021

  1. Energetics of Electron Pairs in Electrophilic Aromatic Substitutions

    Molecules (Basel, Switzerland), Vol. 26, Núm. 2

  2. Understanding topological insulators in real space

    Molecules, Vol. 26, Núm. 10

2020

  1. Real-Space Approach to the Reaction Force: Understanding the Origin of Synchronicity/Nonsynchronicity in Multibond Chemical Reactions

    Journal of Physical Chemistry A, Vol. 124, Núm. 10, pp. 1959-1972

2019

  1. A chemical theory of topological insulators

    Chemical Communications, Vol. 55, Núm. 82, pp. 12281-12287

  2. A first step towards quantum energy potentials of electron pairs

    Physical Chemistry Chemical Physics, Vol. 21, Núm. 8, pp. 4215-4223

  3. Nine questions on energy decomposition analysis

    Journal of Computational Chemistry, Vol. 40, Núm. 26, pp. 2248-2283

  4. Valence-Shell Electron-Pair Repulsion Theory Revisited: An Explanation for Core Polarization

    Chemistry - A European Journal, Vol. 25, Núm. 46, pp. 10938-10945

2018

  1. Building Fluorinated Hybrid Crystals: Understanding the Role of Noncovalent Interactions

    Crystal Growth and Design, Vol. 18, Núm. 11, pp. 6901-6910

2015

  1. Preface to the Special Issue on "Understanding structure and reactivity from topology and beyond"

    Computational and Theoretical Chemistry

  2. Six questions on topology in theoretical chemistry

    Computational and Theoretical Chemistry, Vol. 1053, pp. 2-16

2009

  1. Bases for understanding polymerization under pressure: The practical case of CO2

    Journal of Physical Chemistry B, Vol. 113, Núm. 4, pp. 1068-1073

  2. Computation of local and global properties of the electron localization function topology in crystals

    Journal of Chemical Theory and Computation, Vol. 5, Núm. 1, pp. 164-173

  3. Universal compressibility behaviour of ions in ionic crystals

    High Pressure Research

2008

  1. How electron localization function quantifies and pictures chemical changes in a solid: The B3 → B1 pressure induced phase transition in BeO

    Journal of Physical Chemistry B, Vol. 112, Núm. 32, pp. 9787-9794

  2. Useful applications of the electron localization function in high-pressure crystal chemistry

    Journal of Physics and Chemistry of Solids, Vol. 69, Núm. 9, pp. 2204-2207