Ángel Martín Pendás

Universidad de Oviedo — Spain

Physics and Astronomy · Physical Sciences

51h-index11.2kcitations334works4.02yr avg
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Research Topics

Advanced Chemical Physics Studies(159), Crystallography and molecular interactions(83), Spectroscopy and Quantum Chemical Studies(58), X-ray Diffraction in Crystallography(47), Chemical Thermodynamics and Molecular Structure(35)

Publications334 total

Unraveling real-time chemical shifts in the ultrafast regime
arXiv (Cornell University)·2025Open Access
Assessment of Energy Effects Determining <i>cis</i> - <i>trans</i> Proline Isomerization in Dipeptides
ACS Physical Chemistry Au·2025Open Access
Interacting Quantum Atoms Analysis of Covalent and Collective Interactions in Single Elongated Carbon–Carbon Bonds
Molecules·2025Open Access
Metal–Ligand Cooperation in N–H Activation: Bridging Electron-Pushing Formalism and Energy Descriptors
Inorganic Chemistry·2025· 1 citedOpen Access
Focus on Quantum Crystallography
IUCrJ·2025· 1 citedOpen Access
Interacting Quantum Atoms Analysis of Covalent and Collective Interactions in Single Elongated Carbon Carbon Bonds
Preprints.org·2025Open Access
Exhaustive Spatial Sampling for Complete Topology of the Electrostatic Potential
Journal of Computational Chemistry·2025· 2 citedOpen Access
Real Space Partitioning of the First Hyperpolarizability
The Journal of Physical Chemistry A·2025· 1 cited
Magnetic Superexchange and Mott Insulator Mechanisms in Cubic Perovskites: From First-Principles to Canonical Models
Inorganic Chemistry·2025Open Access
Using topology for understanding your computational results
Pure and Applied Chemistry·2025· 1 cited
Code dependence of calculated crystalline electron densities. Possible lessons for quantum crystallography
IUCrJ·2025Open Access
Linnett is Back: Chemical Bonding through the Lens of Born Maxima
Journal of Chemical Theory and Computation·2025· 3 citedOpen Access
Effect of Explicit Hydration on the Cisplatin Reaction Mechanism with Adenine and Guanine
Molecules·2025· 2 citedOpen Access
Pentafluoroorthotellurate Uncovered: Theoretical Perspectives on an Extremely Electronegative Group
Inorganic Chemistry·2025· 6 citedOpen Access
Can we talk about ionic bonds in molecules? Yes, just as we do for covalent bonds
Physical Chemistry Chemical Physics·2025· 1 citedOpen Access
A Survey of Contemporary Applications of Quantum Chemical Topology
Structure and bonding·2025Open Access
Effect of Explicit Hydration on the Cisplatin Reaction Mechanism with Adenine and Guanine
Preprints.org·2024Open Access
Role of the Radical Character in Singlet Fission: An Ab Initio and Quantum Chemical Topology Analysis
The Journal of Physical Chemistry A·2024· 2 cited
Structural evolution and bonding within molybdenum-doped tin clusters, MoSnn (n = 2 – 15)
Inorganica Chimica Acta·2024Open Access
Linnett is back: understanding chemical bonds through the lens of Born maxima
2024Open Access
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Frequent Co-authors

E. Francisco(28), M. A. Blanco(24), Aurora Costales(11), Vı́ctor Luaña(11), J. M. Recio(8), Paul L. A. Popelier(6), Paula Mori‐Sánchez(5), Tomás Rocha‐Rinza(5), José Manuel Guevara‐Vela(4), Marco A. García‐Revilla(4), Carlo Gatti(3), Bernard Silvi(3), José Luis Casals‐Sainz(3), R. Franco(2), M. Flórez(2), Juán Andrés(2), Paul W. Ayers(2), Roberto A. Boto(2), Ramon Carbó‐Dorca(2), Jerzy Ciosłowski(2)