Evelio Francisco

Publication Activity (10 Years)

Years Active: 2005-2022
Publications (10 Years): 4

Top Topics

Images With Ground Truth

Prize Collecting

Distribution Function

Top Venues

J. Comput. Chem.

Comput. Phys. Commun.

J. Chem. Inf. Model.

Publications

Roberto López, Natalia Díaz, Evelio Francisco, Ángel Martín Pendás, Dimas Suárez
QM/MM Energy Decomposition Using the Interacting Quantum Atoms Approach. J. Chem. Inf. Model. 62 (6) (2022)
José Luis Casals-Sainz, José Manuel Guevara-Vela, Evelio Francisco, Tomás Rocha-Rinza, Ángel Martín Pendás
Efficient implementation of the interacting quantum atoms energy partition of the second-order Møller-Plesset energy. J. Comput. Chem. 41 (13) (2020)
Evelio Francisco, Daniel Menéndez Crespo, Aurora Costales, Ángel Martín Pendás
A multipolar approach to the interatomic covalent interaction energy. J. Comput. Chem. 38 (11) (2017)
Fernando José Holguín-Gallego, Rodrigo Chávez-Calvillo, Marco García-Revilla, Evelio Francisco, Ángel Martín Pendás, Tomás Rocha-Rinza
Electron correlation in the interacting quantum atoms partition via coupled-cluster lagrangian densities. J. Comput. Chem. 37 (19) (2016)
Marcos Menéndez, Roberto Álvarez Boto, Evelio Francisco, Ángel Martín Pendás
One-electron images in real space: Natural adaptive orbitals. J. Comput. Chem. 36 (11) (2015)
Evelio Francisco, Ángel Martín Pendás
Electron number distribution functions from molecular wavefunctions. Version 2. Comput. Phys. Commun. 185 (10) (2014)
Ángel Martín Pendás, M. A. Blanco, Evelio Francisco
Steric repulsions, rotation barriers, and stereoelectronic effects: A real space perspective. J. Comput. Chem. 30 (1) (2009)
Evelio Francisco, Ángel Martín Pendás, M. A. Blanco
EDF: Computing electron number probability distribution functions in real space from molecular wave functions. Comput. Phys. Commun. 178 (8) (2008)
Ángel Martín Pendás, M. A. Blanco, Evelio Francisco
Chemical fragments in real space: Definitions, properties, and energetic decompositions. J. Comput. Chem. 28 (1) (2007)
Ángel Martín Pendás, Evelio Francisco, M. A. Blanco
Two-electron integrations in the Quantum Theory of Atoms in Molecules with correlated wave functions. J. Comput. Chem. 26 (4) (2005)