Advances in Quantum Chemical Topology Beyond QTAIM

1. Introduction to QTAIM and beyond
Fernando Cortes-Guzman, Juan I. Rodriguez, and James S. M. Anderson
2. An Introduction to Quantum Chemistry
David C. Thompson and Juan I. Rodriguez
3. New high performance QTAIM algorithms: From organic photovoltaics to catalyst materials
Juan I. Rodriguez, Hector Daniel Morales-Rodriguez, Emiliano Dorantes-Hernandez and Omar A. Alvarez-Gonzaga
4. Structural and Bond Evolutions During a Chemical Reaction
Pablo Carpio-Martinez and Fernando Cortes-Guzman
5. The MC-QTAIM: A framework for extending the "atoms in molecules" analysis beyond purely electronic systems
Shant Shahbazian
6. Theory Developments and Applications of Next Generation QTAIM (NG-QTAIM)
Xing Nie, Yong Yang, Tianlv Xu, Steven R. Kirk, and Samantha Jenkins
7. Real-Space Description of Molecular Processes in Electronic Excited States
Jesus Jara-Cortes and Jesus Hernandez-Trujillo
8. Open Quantum Systems, Electron Distribution Functions, Fragment Natural Orbitals and the Quantum Theory of Atoms in Molecules
Evelio Francisco, Aurora Costales and Angel Martin Pendas
9. The Ehrenfest Force
Yoshio Barrera, Airi Kawasaki, Paul W. Ayers and James S. M. Anderson
10. Relativistic QTAIM
James S. M. Anderson
11. Chemical insights from the Source Function reconstruction of various scalar fields relevant to Chemistry
Carlo Gatti and Giovanna Bruno
12. Scalar and vector fields derived from magnetically induced current density
Jose E. Barquera-Lozada
13. Gradient Bundles
Amanda Morgenstern
14. Nonnuclear Maxima in the Molecular Electron Density
James S. M. Anderson, Aldo de Jesus Mortera-Carbonell and Cherif F. Matta
15. Spin Polarization of the Atomic Valence Shell in Metal Complexes.
David I. Ramirez-Palma, Ricardo Almada-Monter, Eduardo Orozco-Valdespino, Rosa Maria Gomez-Espinosa and Fernando Cortes-Guzman
16. A Bond Bundle Case Study of Diels-Alder Catalysis and Selectivity Using Oriented Electric Fields
Timothy R. Wilson and M. E. Eberhart
17. Applications of the Quantum Theory of Atoms in Molecules and the Interacting Quantum Atoms Methods to the Study of Hydrogen Bonds
Jose Manuel Guevara-Vela, Alberto Fernandez-Alarcon and Tomas Rocha-Rinza
18. Recent advances on halogen bonds within the quantum theory of atoms in molecules
Vincent Tognetti and Laurent Joubert
19. The Non-Covalent Interactions index: from biology to chemical reactivity and solid-state
Bruno Landeros-Rivera and Julia Contreras-Garcia
20. Photochemistry: a topological perspective
Ismael Vargas-Rodriguez and Marco Garcia-Revilla

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• Química física

Quantum theory of atoms in molecules; Atomic partitioning; Theoretical and computational chemistry; Quantum chemical topology; Bader quantum theory; Chemical bonding; Chemical structure; Chemical reactivity; Quantum mechanics; Local and integrated properties