Javier Carmona-Espíndola
8PUBLICATIONS
11CO-AUTHORS
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Publications (8)
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|Mar 18, 2026
Constrained Multipole Moment Density Functional Theory for the Frozen Contribution in Non-Covalent Complexes.Javier Carmona-Espíndola, José L Gázquez
|Mar 24, 2025
Constrained dipole moment density functional theory for the calculation of the charge-transfer energy in non-covalent complexes.Eduardo Zúñiga-Rivera, Javier Carmona-Espíndola, José L Gázquez
|Dec 17, 2024
Charge-transfer energy through the dipole moment.Javier Carmona-Espíndola, Anaid Flores, Joel Ireta
|Oct 08, 2024
ADCHα-I population analysis and constrained dipole moment density functional theory in force fields for molecular simulations.Javier Carmona-Espíndola, Valeria García-Melgarejo, Edgar Núñez-Rojas
|Sep 22, 2022
Hardness of molecules and bandgap of solids from a generalized gradient approximation exchange energy functional.Javier Carmona-Espíndola, Anaid Flores, José L Gázquez
|Jan 25, 2020
Negative Electron Affinities and Derivative Discontinuity Contribution from a Generalized Gradient Approximation Exchange Functional.Javier Carmona-Espíndola, José L Gázquez, Alberto Vela
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Frequent Collaborators
8 joint publications
José L Gázquez
4 joint publications
Alberto Vela
3 joint publications
S B Trickey
1 joint publications
Valeria García-Melgarejo
1 joint publications
Edgar Núñez-Rojas
1 joint publications
Samantha Mendoza
1 joint publications
Abraham García
1 joint publications
José Alejandre
1 joint publications
Anaid Flores
1 joint publications
Joel Ireta
