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Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry|January 26, 2021
Energetic Descriptors of Steric Hindrance in Real Space: An Improved IQA Picture*Miguel Gallegos, Aurora Costales, Ángel Martín PendásJournal of Computational Chemistry|March 12, 2022
A real space picture of the role of steric effects in S<sub>N</sub> 2 reactionsMiguel Gallegos, Aurora Costales, Ángel Martín PendásThe Journal of Physical Chemistry. A|March 15, 2022
Does Steric Hindrance Actually Govern the Competition between Bimolecular Substitution and Elimination Reactions?Miguel Gallegos, Aurora Costales, Ángel Martín PendásPhysical Chemistry Chemical Physics : PCCP|January 25, 2014
On the interpretation of domain averaged Fermi hole analyses of correlated wavefunctionsE Francisco, A Martín Pendás, Aurora CostalesThe Journal of Physical Chemistry. B|July 21, 2006
Structural, energetic, electronic, bonding, and vibrational properties of Ga3O, Ga3O2, Ga3O3, Ga2O3, and GaO3 clustersS Gowtham, Mrinalini Deshpande, Aurora Costales, et al.Journal of Computational Chemistry|February 18, 2017
A multipolar approach to the interatomic covalent interaction energyEvelio Francisco, Daniel Menéndez Crespo, Aurora Costales, et al.Chemistry (Weinheim an Der Bergstrasse, Germany)|April 15, 2018
Real-Space In Situ Bond Energies: Toward A Consistent Energetic Definition of Bond StrengthDaniel Menéndez-Crespo, Aurora Costales, Evelio Francisco, et al.The Journal of Physical Chemistry. A|April 28, 2021
Lewis Structures from Open Quantum Systems Natural Orbitals: Real Space Adaptive Natural Density PartitioningEvelio Francisco, Aurora Costales, María Menéndez-Herrero, et al.The Journal of Physical Chemistry. B|March 3, 2006
First principles study of neutral and anionic (medium-size) aluminum nitride clusters: AlnNn, n=7-16Aurora Costales, M A Blanco, E Francisco, et al.The Journal of Physical Chemistry. B|December 27, 2005
Evolution of the properties of Al(n)N(n) clusters with sizeAurora Costales, M A Blanco, E Francisco, et al.Pageof 3