Transition Metals in Coordination Environments

Computational Chemistry and Catalysis Viewpoints
Artikelnummer: 978-3-030-11713-9
Einband: Fester Einband
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This book focuses on the electronic properties of transition metals in coordination environments. These properties are responsible for the unique and intricate activity of transition metal sites in bio- and inorganic catalysis, but also pose challenges for both theoretical and experimental studies. Written by an international group of recognized experts, the book reviews recent advances in computational modeling and discusses their interplay using experiments. It covers a broad range of topics, including advanced computational methods for transition metal systems; spectroscopic, electrochemical and catalytic properties of transition metals in coordination environments; metalloenzymes and biomimetic compounds; and spin-related phenomena. As such, the book offers an invaluable resource for all researchers and postgraduate students interested in both fundamental and application-oriented research in the field of transition metal systems.

This book focuses on the electronic properties of transition metals in coordination environments. These properties are responsible for the unique and intricate activity of transition metal sites in bio- and inorganic catalysis, but also pose challenges for both theoretical and experimental studies. Written by an international group of recognized experts, the book reviews recent advances in computational modeling and discusses their interplay using experiments. It covers a broad range of topics, including advanced computational methods for transition metal systems; spectroscopic, electrochemical and catalytic properties of transition metals in coordination environments; metalloenzymes and biomimetic compounds; and spin-related phenomena. As such, the book offers an invaluable resource for all researchers and postgraduate students interested in both fundamental and application-oriented research in the field of transition metal systems.

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VerlagSpringer EN
EinbandFester Einband
Erscheinungsjahr2019
Seitenangabe532 S.
AusgabekennzeichenEnglisch
AbbildungenXV, 532 p. 209 illus., 171 illus. in color., schwarz-weiss Illustrationen, farbige Illustrationen
MasseH23.5 cm x B15.5 cm 980 g
CoverlagSpringer (Imprint/Brand)
ReiheChallenges and Advances in Computational Chemistry and Physics
AutorBroclawik, Ewa (Hrsg.) / Borowski, Tomasz (Hrsg.) / Radon, Mariusz (Hrsg.)

Alle Bände der Reihe "Challenges and Advances in Computational Chemistry and Physics"

Über den Autor Ewa (Hrsg.) Broclawik

Ewa Broclawik is a Professor Emeritus and former Full Professor at the Jerzy Haber Institute of Catalysis and Surface Chemistry, Polish Academy of Sciences in Krakow, Poland. Her research interests focus on theoretical and applied quantum chemistry, in particular on the modeling of active sites in heterogeneous and enzymatic catalysis and on catalytic reaction mechanisms. Dr. Broclawik is the author of more than 180 publications, including 9 book chapters.   Tomasz Borowski is a Full Professor at the Jerzy Haber Institute of Catalysis and Surface Chemistry, Polish Academy of Sciences. His research interests encompass computational chemistry, biochemistry, reaction mechanisms, metalloenzymes, and protein structure and dynamics. Dr. Borowski has published more than 60 research papers in refereed journals as well as 3 book chapters. Mariusz Radon is an Assistant Professor at Jagiellonian University,Krakow, Poland. His primary research interest is in quantum chemistry, especially its applications to transition metal complexes and active sites of metalloproteins, with a focus on electronic structure, spin-state energetics, metal-ligand interactions and connections to catalytic activity. Dr. Radon is the author of 30 publications, including 1 book chapter. 

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