Publications by Prof. Tapia-Olivares

An electronic book in Quantum Physical Chemistry

Quantum Physical Chemsitry - Basic Quantum Mechanics for Process Description

by Orlando Tapia

(This is the final version of the book. Anyone will have access to the contents of our work for free. The book is available in pdf format, and is linked to each chapter separately, due to the size.)

Preface and list of content

Chapter 1. Quantum Language in Chemistry

Chapter 2. Basic Quantum Formalism

Chapter 3. Quantum Theory in Space-time I-frames

Chapter 4. Quantum states for simple systems

Chapter 5. Elements of quantum electromagnetism

Chapter 6. Basic Relativistic Quantum Mechanics

Chapter 7. Statistics and quantum molecular issues

Chapter 8. Modulating quantum states: Fence

Chapter 9. Preparing-Detecting-Measuring-Modeling

Publications

On interpretations of quantum mechanics and a novel nonrepresentational framework

Ludena, Eduardo V.; Tapia, Orlando

Part of New electron correlation methods and their applications, and use of atomic orbitals with exponential asymptotes, p. 1-29, 2021.

DOI for On interpretations of quantum mechanics and a novel nonrepresentational framework
State-Quantum-Chemistry Set in a Photonic Framework

Tapia, Orlando

Part of Advances in Quantum Chemistry, p. 227-251, 2017.

DOI for State-Quantum-Chemistry Set in a Photonic Framework
Quantum-matter photonic framework perspective of chemical processes: Entanglement shifts in HCN/CNH isomerization

Tapia-Olivares, Orlando

Part of International Journal of Quantum Chemistry, p. 1490-1500, 2015.

DOI for Quantum-matter photonic framework perspective of chemical processes: Entanglement shifts in HCN/CNH isomerization
Constructing quantum mechanical models from diabatic schemes: external field modulation of effective energy barriers for bond breaking/formation processes

Arteca, Gustavo A.; Laverdure, Laura; Tapia-Olivares, Orlando

Part of Journal of Mathematical Chemistry, p. 2395-2410, 2014.

DOI for Constructing quantum mechanical models from diabatic schemes: external field modulation of effective energy barriers for bond breaking/formation processes
Quantum photonic base states: concept and molecular modeling. Managing chemical process descriptions beyond semi-classic schemes

Tapia, Orlando

Part of Journal of Molecular Modeling, p. 2110-, 2014.

DOI for Quantum photonic base states: concept and molecular modeling. Managing chemical process descriptions beyond semi-classic schemes
Constructing quantum mechanical models starting from diabatic schemes: Quantum states for simulations bond break/formation-I. Feshbach-like quantum states and electronuclear wave functions

Arteca, Gustavo A.; Aullo, Josep M.; Tapia, Orlando

Part of Journal of Mathematical Chemistry, p. 949-970, 2012.

DOI for Constructing quantum mechanical models starting from diabatic schemes: Quantum states for simulations bond break/formation-I. Feshbach-like quantum states and electronuclear wave functions
Oxygenation of the phenylhalocarbenes: Are they spin-allowed or spin-forbidden reactions?

Mokhtar Lamsabhi, Al; Corral, Ines; Perez, Patricia; Tapia, Orlando et al.

Part of Journal of Molecular Modeling, p. 2813-2821, 2012.

DOI for Oxygenation of the phenylhalocarbenes: Are they spin-allowed or spin-forbidden reactions?
A Theoretical Study of Semiclassic Models: Toward a Quantum Mechanical Representation of Chemical Processes

Crespo, R.; Piqueras, M-C; Aullo, J. M.; Tapia, Orlando

Part of International Journal of Quantum Chemistry, p. 263-271, 2011.

DOI for A Theoretical Study of Semiclassic Models: Toward a Quantum Mechanical Representation of Chemical Processes
Quantum States for Quantum Measurements

Tapia, Orlando

Part of ADVANCES IN QUANTUM CHEMISTRY, VOL. 61, p. 49-106, 2011.

DOI for Quantum States for Quantum Measurements
Generalized electronic diabatic approach to structural similarity and the Hammond postulate

Arteca, Gustavo A.; Tapia, Orlando

Part of International Journal of Quantum Chemistry, p. 382-395, 2007.

DOI for Generalized electronic diabatic approach to structural similarity and the Hammond postulate
Can chemistry be derived from quantum mechanics? Chemical dynamics and structure

Tapia, Orlando

Part of Journal of Mathematical Chemistry, p. 637-669, 2006.
A quantum theory of chemical processes and reaction rates based on diabatic electronic functions coupled in an external field.

Arteca, Gustavo A.; Tapia, Orlando

Part of Journal of Matematical Chemistry, p. 389-408, 2005.
A three-state model for electronic transitions represented in a generalized diabatic approach

Arteca, Gustavo A.; Tapia, Orlando

Part of Journal of Mathematical Chemistry, p. 159-174, 2004.
Generalized Electronic Diabatic Ansatz: A Post-Born--Oppenheimer Approach to Electronuclear Dynamics in External Fields

Tapia, Orlando; Arteca, Gustavo A.

Part of Advances in Quantum Chemistry, p. 275-291, 2004.
Generalized electronic diabatic scheme: Diagonalizing the electronic Hamiltonian for artificial molecular systems. How do molecular meccanos move?

Tapia, Orlando

Part of International Journal of Quantum Chemistry, p. 637-650, 2004.
Towards a quantum molecular measurement theory: Stern-Gerlach thought experiments at the interface of Hilbert and real spaces

Tapia, Orlando; Fidder, Henk

Part of Journal of the Chilean Chemical Society, p. 113-, 2004.
Transition structures for hydride transfer reactions in vacuo and their role in enzyme catalysis

Andres, J; Moliner, V; Safont, VS; Aullo, JM et al.

Part of Journal of Molecular Structure: THEOCHEM, p. 299-312, 1996.

DOI for Transition structures for hydride transfer reactions in vacuo and their role in enzyme catalysis