Publikationer av Prof. Tapia-Olivares
En elektronisk bok i kvant-fysikalisk kemi
Quantum Physical Chemsitry - Basic Quantum Mechanics for Process Description
av Orlando Tapia
(Detta är den slutliga versionen av boken. Vem som helst får tillgång till innehållet gratis. Boken är i pdf-format och varje kapitel är inlagt var för sig på grund av storleken.)
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
Publikationer
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On interpretations of quantum mechanics and a novel nonrepresentational framework
Ingår i New electron correlation methods and their applications, and use of atomic orbitals with exponential asymptotes, s. 1-29, 2021.
DOI för On interpretations of quantum mechanics and a novel nonrepresentational framework
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State-Quantum-Chemistry Set in a Photonic Framework
Ingår i Advances in Quantum Chemistry, s. 227-251, 2017.
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Quantum-matter photonic framework perspective of chemical processes: Entanglement shifts in HCN/CNH isomerization
Ingår i International Journal of Quantum Chemistry, s. 1490-1500, 2015.
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Constructing quantum mechanical models from diabatic schemes: external field modulation of effective energy barriers for bond breaking/formation processes
Ingår i Journal of Mathematical Chemistry, s. 2395-2410, 2014.
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Quantum photonic base states: concept and molecular modeling. Managing chemical process descriptions beyond semi-classic schemes
Ingår i Journal of Molecular Modeling, s. 2110-, 2014.
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Constructing quantum mechanical models starting from diabatic schemes: Quantum states for simulations bond break/formation-I. Feshbach-like quantum states and electronuclear wave functions
Ingår i Journal of Mathematical Chemistry, s. 949-970, 2012.
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Oxygenation of the phenylhalocarbenes: Are they spin-allowed or spin-forbidden reactions?
Ingår i Journal of Molecular Modeling, s. 2813-2821, 2012.
DOI för Oxygenation of the phenylhalocarbenes: Are they spin-allowed or spin-forbidden reactions?
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A Theoretical Study of Semiclassic Models: Toward a Quantum Mechanical Representation of Chemical Processes
Ingår i International Journal of Quantum Chemistry, s. 263-271, 2011.
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Quantum States for Quantum Measurements
Ingår i ADVANCES IN QUANTUM CHEMISTRY, VOL. 61, s. 49-106, 2011.
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Generalized electronic diabatic approach to structural similarity and the Hammond postulate
Ingår i International Journal of Quantum Chemistry, s. 382-395, 2007.
DOI för Generalized electronic diabatic approach to structural similarity and the Hammond postulate
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Can chemistry be derived from quantum mechanics? Chemical dynamics and structure
Ingår i Journal of Mathematical Chemistry, s. 637-669, 2006.
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A quantum theory of chemical processes and reaction rates based on diabatic electronic functions coupled in an external field.
Ingår i Journal of Matematical Chemistry, s. 389-408, 2005.
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A three-state model for electronic transitions represented in a generalized diabatic approach
Ingår i Journal of Mathematical Chemistry, s. 159-174, 2004.
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Generalized Electronic Diabatic Ansatz: A Post-Born--Oppenheimer Approach to Electronuclear Dynamics in External Fields
Ingår i Advances in Quantum Chemistry, s. 275-291, 2004.
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Generalized electronic diabatic scheme: Diagonalizing the electronic Hamiltonian for artificial molecular systems. How do molecular meccanos move?
Ingår i International Journal of Quantum Chemistry, s. 637-650, 2004.
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Towards a quantum molecular measurement theory: Stern-Gerlach thought experiments at the interface of Hilbert and real spaces
Ingår i Journal of the Chilean Chemical Society, s. 113-, 2004.
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Transition structures for hydride transfer reactions in vacuo and their role in enzyme catalysis
Ingår i Journal of Molecular Structure: THEOCHEM, s. 299-312, 1996.