• Produktbild: Theoretical and Computational Photochemistry
  • Produktbild: Theoretical and Computational Photochemistry

Theoretical and Computational Photochemistry Fundamentals, Methods, Applications and Synergy with Experimental Approaches

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Beschreibung

Produktdetails

Einband

Taschenbuch

Erscheinungsdatum

28.04.2023

Herausgeber

García Iriepa Cristina + weitere

Verlag

Elsevier Science & Technology

Seitenzahl

518

Maße (L/B/H)

27.6/21/3 cm

Gewicht

1400 g

Sprache

Englisch

ISBN

978-0-323-91738-4

Beschreibung

Portrait

Dr. Cristina García Iriepa received her BSc in chemistry (Bachelor excellence award) in 2011 and her MSc in Fine Chemistry in 2012 from the University of Alcalá (Spain). She obtained her PhD in chemistry in 2016 studying photoactive devices both, from a computational (at the University of Alcalá) and experimental (at the University of La Rioja, Spain) point of view. After, she performed postdoctoral stages at the Université Marne-la-Vallée (France) studying bioluminescent processes, at the University of La Rioja strengthening her background in molecular photoswitches and at the University of Alcalá. Finally, in 2019, she was appointed Assistant Professor at the University of Alcalá. Currently, she is interested on photochemical processes, particularly focused on the application of molecular devices and photoactive proteins.

Marco Marazzi is an Associate Professor at the Physical Chemistry Unit of the University of Alcalá, Spain. He obtained his bachelor’s degree in chemistry with a major in Materials Chemistry at the Sapienza University in Rome, Italy, his Masters in Polymer Science in Berlin, Germany and his PhD in Chemistry at the University of Alcalá, Spain in 2013, working on the theoretical development and computational application of photochemical and photophysical tools. After postdoctoral stages at the Karlsruhe Institute of Technology (KIT), Germany, as a Humboldt fellow, the French national research council (CNRS), and the University of La Rioja, Spain, strengthening his skills in excited state molecular dynamics and in different photoinduced processes, he was appointed Assistant Professor at the University of Alcalá in 2019. Since then, his interests have included the design of solar energy storage systems, as well as hydrogen release and photoinduced hydrogen production. He was visiting researcher at the University of Uppsala, Sweden, Bowling Green State University, Ohio, USA, Northwestern University, Illinois, USA, and Université Gustave Eiffel, France. He is the author of more than seventy journal publications, four book chapters, and was co-Editor of Theoretical and Computational Photochemistry (Elsevier, 2023) with Cristina García Iriepa

Produktdetails

Einband

Taschenbuch

Erscheinungsdatum

28.04.2023

Herausgeber

Verlag

Elsevier Science & Technology

Seitenzahl

518

Maße (L/B/H)

27.6/21/3 cm

Gewicht

1400 g

Sprache

Englisch

ISBN

978-0-323-91738-4

Herstelleradresse

Libri GmbH
Europaallee 1
36244 Bad Hersfeld
DE

Email: gpsr@libri.de

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Die Leseprobe wird geladen.
  • Produktbild: Theoretical and Computational Photochemistry
  • Produktbild: Theoretical and Computational Photochemistry
  • Part 1: Fundamentals
    1. Electronic excitations in molecules
    2. Potential Energy Surfaces

    Part 2: Methods
    3. Density Functional Theory
    4. Density Functional Tight Binding
    5. Algebraic Diagrammatic Construction
    6. Multiconfigurational Quantum Chemistry
    7. Equation-of-motion Coupled-Cluster
    8. Machine Learning methods in photochemistry

    Part 3: Approaches, Applications and Comparison with Experiments
    9. Molecular Devices
    10. Solar Cells
    11. Thermally Activated Delayed Fluorescence
    12. DNA behaviour and implications
    13. Chemi- and bioluminescence
    14. Photoactive proteins
    15. Photocatalysis
    16. Dynamics and Spin Orbit Coupling
    17. 2D Spectroscopy
    18. Mechanophotochemistry
    19. Synergy Between Theory and Experimentation