Ángel Martín Pendás
Orcid: 0000-0002-4471-4000
According to our database1,
Ángel Martín Pendás
authored at least 18 papers
between 2005 and 2024.
Collaborative distances:
Collaborative distances:
Timeline
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Online presence:
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Bibliography
2024
An Unsupervised Machine Learning Approach for the Automatic Construction of Local Chemical Descriptors.
J. Chem. Inf. Model., 2024
2023
Developing a User-Friendly Code for the Fast Estimation of Well-Behaved Real-Space Partial Charges.
J. Chem. Inf. Model., July, 2023
2022
J. Chem. Inf. Model., 2022
J. Comput. Chem., 2022
2021
Challenging the electrostatic σ-hole picture of halogen bonding using minimal models and the interacting quantum atoms approach.
J. Comput. Chem., 2021
2020
J. Comput. Chem., 2020
Efficient implementation of the interacting quantum atoms energy partition of the second-order Møller-Plesset energy.
J. Comput. Chem., 2020
2019
2017
Chemical bonding in excited states: Energy transfer and charge redistribution from a real space perspective.
J. Comput. Chem., 2017
J. Comput. Chem., 2017
2016
Electron correlation in the interacting quantum atoms partition via coupled-cluster lagrangian densities.
J. Comput. Chem., 2016
2015
2014
Comput. Phys. Commun., 2014
2009
Steric repulsions, rotation barriers, and stereoelectronic effects: A real space perspective.
J. Comput. Chem., 2009
Critic: a new program for the topological analysis of solid-state electron densities.
Comput. Phys. Commun., 2009
2008
EDF: Computing electron number probability distribution functions in real space from molecular wave functions.
Comput. Phys. Commun., 2008
2007
Chemical fragments in real space: Definitions, properties, and energetic decompositions.
J. Comput. Chem., 2007
2005
Two-electron integrations in the Quantum Theory of Atoms in Molecules with correlated wave functions.
J. Comput. Chem., 2005