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Chemical Physics and Physical Chemistry Editor's Pick 2024
We are pleased to introduce Frontiers in Chemistry—Chemical Physics and Physical Chemistry Editor's Pick 2024. This collection showcases the most well-received spontaneous articles from the past couple of years and has been specially handpicked by our Chief Editor. The work presented here highlights the broad diversity of research performed across the section and aims to spotlight the main areas of interest. All research presented here displays strong advances in theory, experiment, and methodology, with applications to compelling problems.
Computational Strategies for Spectroscopy
Computational spectroscopy is a rapidly evolving field that is becoming a versatile and widespread tool for the assignment of experimental spectra and their interpretation as related to chemical physical effects. This book is devoted to the most significant methodological contributions in the field, and to the computation of IR, UV-VIS, NMR and EPR spectral parameters with reference to the underlying vibronic and environmental effects. Each section starts with a chapter written by an experimental spectroscopist dealing with present challenges in the different fields; comprehensive coverage of conventional and advanced spectroscopic techniques is provided by means of dedicated chapters written by experts. Computational chemists, analytical chemists and spectroscopists, physicists, materials scientists, and graduate students will benefit from this thorough resource.
Combining Quantum Mechanics and Molecular Mechanics. Some Recent Progresses in QM/MM Methods
Advances in Quantum Chemistry presents surveys of current developments in this rapidly developing field. With invited reviews written by leading international researchers, each presenting new results, it provides a single vehicle for following progress in this interdisciplinary area. - Publishes articles, invited reviews and proceedings of major international conferences and workshops - Written by leading international researchers in quantum and theoretical chemistry - Highlights important interdisciplinary developments
Dynamics at Surfaces: Understanding Energy Dissipation and Physicochemical Processes at the Atomic and Molecular Level
Energy release to solid interfaces following chemical reactions is ubiquitous in a vast range of phenomena. Energy dissipation and dynamical disorder (surface entropy), surface friction and molecular diffusion control the rates of heterogeneous catalytic reactions, the efficiency of novel technology, lubrication as well as materials growth including self-assembly and nano-structures. Yet we understand little about the underlying nature of these mechanisms. Fundamentally, energy dissipation including interactions with phonons and electron-hole pairs determines the lifetime of molecular vibrations and rotations as well as the decoherence rate of quantum states. These processes form a central point for many aspects in physical chemistry, are embedded in the mechanisms that control surface dynamical processes and are critical factors in catalysis. They are equally relevant for physicochemical processes in the Earth's atmosphere and astrochemistry occurring on cosmic dust grains.
Frontiers in Chemistry: 10 Years Anniversary
We are delighted to present the inaugural edition of the article collection, “10 years with Frontiers in Chemistry"*. This collection celebrates high-impact, authoritative and accessible articles covering the most topical research at the forefront of the chemical sciences in honor of Frontiers 10th anniversary. The collection contains works encompassing all of our nineteen sections in Frontiers in Chemistry. Each article was selected by the nomination of our Field Chief Editor, Prof Steve Suib in recognition of the author’s prominence and influence in their respective field, or by virtue of their reputation in the research community. The cutting-edge work presented in this article collec...
Interfacial Water: A Physical Chemistry Perspective, Volume II
Topic Editor Harada receives financial support from AGC Research Collaboration System with the title “Research on the control of biocompatibility based on the analysis of substrate surface”. The other Topic Editors declare no competing interests
