Néstor F. Aguirre - Concepedia

Author

Néstor F. Aguirre

Centre National de la Recherche Scientifique ORCID

Also Known As

Aguirre, Nestor F., Aguirre, Néstor F., N Aguirre, N F Aguirre, N. F. Aguirre, N.F. Aguirre, Nestor F. Aguirre, Néstor Aguirre, Néstor F Aguirre, Néstor F. Aguirre

Publications

551

Citations

H-Index

Concepts

All Affiliations

Centre National de la Recherche Scientifique Instituto de Física Fundamental Laboratoire Modélisation et Simulation Multi-Echelle Universidad Autónoma de Madrid Universidad Nacional de Colombia

About

Néstor F. Aguirre is an author at Centre National de la Recherche Scientifique specializing in engineering, physics, and quantum chemistry.

Top Concepts

#	Concept	H-Index	Publications	Citations
1	Engineering	7	7	226
2	Natural Sciences	6	6	213
3	Chemistry	6	6	165
4	Materials Science	2	2	44
5	Applied Physics	1	1	31

Néstor F. Aguirre

Publications

506

Citations

H-Index

Page 1

	Year	Citations
Theoretical investigation of isotope effects: The any‐particle molecular orbital code Sergio A. González, Néstor F. Aguirre, Andrés Reyes International Journal of Quantum Chemistry EngineeringComputational ChemistryChemistryMolecular DynamicsMolecular Simulation	2008	67
The Amsterdam Modeling Suite Evert Jan Baerends, Néstor F. Aguirre, N. Austin, The Journal of Chemical Physics	2025	63
LOWDIN: The any particle molecular orbital code Roberto Flores‐Moreno, E. Posada, Félix Moncada, International Journal of Quantum Chemistry EngineeringMolecular BiologyComputational ChemistryMolecular ComputingMolecular Design	2013	61
Communication: Unraveling the 4He droplet-mediated soft-landing from <i>ab initio</i>-assisted and time-resolved density functional simulations: Au@4He300/TiO2(110) María Pilar de Lara‐Castells, Néstor F. Aguirre, Hermann Stoll, The Journal of Chemical Physics	2015	41
Graph Theoretical Similarity Approach To Compare Molecular Electrostatic Potentials Ray M. Marín, Néstor F. Aguirre, Édgar E. Daza Journal of Chemical Information and Modeling	2008	36
Helium mediated deposition: Modeling the He−TiO<sub>2</sub>(110)-(1×1) interaction potential and application to the collision of a helium droplet from density functional calculations Néstor F. Aguirre, David Mateo, Alexander O. Mitrushchenkov, The Journal of Chemical Physics Helium DropletEngineeringComputational ChemistryChemistryMolecular Dynamics	2012	31
Furan Fragmentation in the Gas Phase: New Insights from Statistical and Molecular Dynamics Calculations Ewa Erdmann, Marta Łabuda, Néstor F. Aguirre, The Journal of Physical Chemistry A	2018	26
M<sub>3</sub>C: A Computational Approach To Describe Statistical Fragmentation of Excited Molecules and Clusters Néstor F. Aguirre, Sergio Díaz‐Tendero, Paul-Antoine Hervieux, Journal of Chemical Theory and Computation	2016	24
Structure, Ionization, and Fragmentation of Neutral and Positively Charged Hydrogenated Carbon Clusters: C<sub><i>n</i></sub>H<sub><i>m</i></sub><sup><i>q</i>+</sup> (<i>n</i> = 1–5, <i>m</i> = 1–4, <i>q</i> = 0–3) Juan Pablo Mojica-Sánchez, Néstor F. Aguirre, Sergio Díaz‐Tendero, The Journal of Physical Chemistry A EngineeringComputational ChemistryChemistryMolecular DynamicsSpectra-structure Correlation	2015	22
Bonding in exohedral metal–fullerene cationic complexes Maitreyi Robledo, Néstor F. Aguirre, Sergio Díaz‐Tendero, RSC Advances Inorganic ChemistryEngineeringPhysicsTheoretical Inorganic ChemistryNatural Sciences	2014	21

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