Juan-Carlos Sancho-García

47PUBLICATIONS
65CO-AUTHORS
Organic semiconductorsTheoretical quantum chemistryCondensed matter modelling and density functional theoryRadiation and matterStatistical mechanics in chemistry
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Publications (47)

|Jul 16, 2026
(SOS1-)PBE-DH-INVEST double hybrid functionals for INVEST systems: Validation for azaphenalene compounds.

|Jan 28, 2026
Contemporary DFT: learning from traditional and recent trends for the development and assessment of accurate exchange-correlation functionals.

E Brémond, A J Pérez-Jiménez, C Adamo

|Jan 09, 2026
Weak Noncovalent Interactions in Nonequilibrium Structures: How Good Are the Dispersion Corrections?

Lorenzo Briccolani-Bandini, Bhavesh Gnnanapareddy, Frédéric Labat

|Dec 31, 2025
Accuracy and Scaling Factors of Non-Empirical Double-Hybrid Density Functionals for Harmonic and Fundamental Frequencies (And ZPVE).

B Miguel, E Brémond, A J Pérez-Jiménez

|Nov 03, 2025
Singlet-Triplet Gap in Covalently and Weakly Bound Carbenes: Studying the Dependence on the Exchange-Correlation Functional.

Pablo Maiz-Pastor, Éric Brémond, Ángel José Pérez-Jiménez

|Jun 10, 2025
Fast and Reliable Evaluation of Intermolecular Interactions with Second-Order Møller-Plesset Perturbation Theory and Small Basis Set.

Lorenzo Briccolani-Bandini, Eric Brémond, Marco Pagliai

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Frequent Collaborators

22 joint publications

Ángel José Pérez-Jiménez

21 joint publications

Carlo Adamo

21 joint publications

Éric Brémond

9 joint publications

Yoann Olivier