Non covalent Interactions in Quantum Chemistry and Physics

Written By Alberto Otero de la Roza
Non covalent Interactions in Quantum Chemistry and Physics
  • Publsiher : Elsevier
  • Release : 15 June 2017
  • ISBN : 0128098368
  • Pages : 476 pages
  • Rating : 4/5 from 21 reviews
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Read or download book entitled Non covalent Interactions in Quantum Chemistry and Physics written by Alberto Otero de la Roza which was release on 15 June 2017, this book published by Elsevier. Available in PDF, EPUB and Kindle Format. Book excerpt: Non-covalent Interactions in Quantum Chemistry and Physics: Theory and Applications provides an entry point for newcomers and a standard reference for researchers publishing in the area of non-covalent interactions. Written by the leading experts in this field, the book enables experienced researchers to keep up with the most recent developments, emerging methods, and relevant applications. The book gives a comprehensive, in-depth overview of the available quantum-chemistry methods for intermolecular interactions and details the most relevant fields of application for those techniques. Theory and applications are put side-by-side, which allows the reader to gauge the strengths and weaknesses of different computational techniques. Summarizes the state-of-the-art in the computational intermolecular interactions field in a comprehensive work Introduces students and researchers from related fields to the topic of computational non-covalent interactions, providing a single unified source of information Presents the theoretical foundations of current quantum mechanical methods alongside a collection of examples on how they can be applied to solve practical problems

Non covalent Interactions in Quantum Chemistry and Physics

Non covalent Interactions in Quantum Chemistry and Physics
  • Author : Alberto Otero de la Roza,Gino A. DiLabio
  • Publisher : Elsevier
  • Release Date : 2017-06-15
  • Total pages : 476
  • ISBN : 0128098368
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Summary : Non-covalent Interactions in Quantum Chemistry and Physics: Theory and Applications provides an entry point for newcomers and a standard reference for researchers publishing in the area of non-covalent interactions. Written by the leading experts in this field, the book enables experienced researchers to keep up with the most recent developments, ...

Noncovalent Forces

Noncovalent Forces
  • Author : Steve Scheiner
  • Publisher : Springer
  • Release Date : 2015-04-16
  • Total pages : 532
  • ISBN : 0128098368
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Summary : Computational methods, and in particular quantum chemistry, have taken the lead in our growing understanding of noncovalent forces, as well as in their categorization. This volume describes the current state of the art in terms of what we now know, and the current questions requiring answers in the future. Topics ...

Noncovalent Interactions in Catalysis

Noncovalent Interactions in Catalysis
  • Author : Kamran T Mahmudov,Maximilian N Kopylovich,M Fatima C Guedes da Silva,Armando J L Pombeiro
  • Publisher : Royal Society of Chemistry
  • Release Date : 2019-03-04
  • Total pages : 644
  • ISBN : 0128098368
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Summary : Noncovalent interactions often provide the spine of biomolecular and material structures, and can therefore play a key role in biological and catalytic processes. Selectivity in chemical reactions, particularly in catalytic processes, is often an orchestral action of various noncovalent interactions occurring in intermediates and transition states. Although the role of ...

Conjugated Polymers

Conjugated Polymers
  • Author : John R. Reynolds,Barry C. Thompson,Terje A. Skotheim
  • Publisher : CRC Press
  • Release Date : 2019-03-27
  • Total pages : 660
  • ISBN : 0128098368
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Summary : The Fourth Edition of the Handbook of Conducting Polymers, Two-Volume Set continues to be the definitive resource on the topic of conducting polymers. Completely updated with an extensive list of authors that draws on past and new contributors, the book takes into account the significant developments both in fundamental understanding ...

Handbook of Computational Chemistry

Handbook of Computational Chemistry
  • Author : Jerzy Leszczynski
  • Publisher : Springer Science & Business Media
  • Release Date : 2012-01-14
  • Total pages : 1427
  • ISBN : 0128098368
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Summary : This handbook is a guide to current methods of computational chemistry, explaining their limitations and advantages and providing examples of their applications. The first part outlines methods, the balance of volumes present numerous important applications....

Non covalent Interactions

Non covalent Interactions
  • Author : Pavel Hobza,Klaus Müller-Dethlefs
  • Publisher : Royal Society of Chemistry
  • Release Date : 2010
  • Total pages : 225
  • ISBN : 0128098368
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Summary : Co-authored by an experimentalist (Klaus M ller-Dethlefs ) and theoretician (Pavel Hobza), the aim of this book is to provide a general introduction into the science behind non-covalent interactions and molecular complexes using some important experimental and theoretical methods and approaches."...

Chemical Physics and Quantum Chemistry

Chemical Physics and Quantum Chemistry
  • Author : Anonim
  • Publisher : Academic Press
  • Release Date : 2020-09-18
  • Total pages : 350
  • ISBN : 0128098368
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Summary : Advances in Quantum Chemistry presents surveys of current topics in this rapidly developing field one that has emerged at the cross section of the historically established areas of mathematics, physics, chemistry, and biology. It features detailed reviews written by leading international researchers. In this volume the readers are presented with ...

Practical Aspects of Computational Chemistry I

Practical Aspects of Computational Chemistry I
  • Author : Jerzy Leszczynski,Manoj Shukla
  • Publisher : Springer Science & Business Media
  • Release Date : 2012-01-13
  • Total pages : 680
  • ISBN : 0128098368
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Summary : Practical Aspects of Computational Chemistry I: An Overview of the Last Two Decades and Current Trends gathers the advances made within the last 20 years by well-known experts in the area of theoretical and computational chemistry and physics. The title itself reflects the celebration of the twentieth anniversary of the “Conference ...

Annual Reports in Computational Chemistry

Annual Reports in Computational Chemistry
  • Author : Anonim
  • Publisher : Elsevier
  • Release Date : 2017-08-24
  • Total pages : 292
  • ISBN : 0128098368
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Summary : Annual Reports in Computational Chemistry, Volume 13 provides timely and critical reviews of important topics in computational chemistry. Topics in this new release include chapters on the Quantum Chemical Model for Molecular Properties and Processes at the Extreme High Pressure, a section on Interpreting Bonding and Spectra with Correlated, One-Electron Concepts ...

Annual Reports in Computational Chemistry

Annual Reports in Computational Chemistry
  • Author : Ralph A. Wheeler
  • Publisher : Newnes
  • Release Date : 2013-09-28
  • Total pages : 128
  • ISBN : 0128098368
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Summary : Annual Reports in Computational Chemistry provides timely and critical reviews of important topics in computational chemistry as applied to all chemical disciplines. Topics covered include quantum chemistry, molecular mechanics, force fields, chemical education, and applications in academic and industrial settings. Focusing on the most recent literature and advances in the ...

Handbook of Conducting Polymers Fourth Edition 2 Volume Set

Handbook of Conducting Polymers  Fourth Edition   2 Volume Set
  • Author : John R. Reynolds,Barry C. Thompson,Terje A. Skotheim
  • Publisher : CRC Press
  • Release Date : 2019-11-14
  • Total pages : 1488
  • ISBN : 0128098368
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Summary : In the last 10 years there have been major advances in fundamental understanding and applications and a vast portfolio of new polymer structures with unique and tailored properties was developed. Work moved from a chemical repeat unit structure to one more based on structural control, new polymerization methodologies, properties, processing, and ...

Practical Aspects of Computational Chemistry V

Practical Aspects of Computational Chemistry V
  • Author : Jerzy Leszczynski
  • Publisher : Springer Nature
  • Release Date : 2022-06-26
  • Total pages : 212
  • ISBN : 0128098368
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Summary : Download or read online Practical Aspects of Computational Chemistry V written by Jerzy Leszczynski, published by Springer Nature which was released on . Get Practical Aspects of Computational Chemistry V Books now! Available in PDF, ePub and Kindle....

Cold Chemistry

Cold Chemistry
  • Author : Olivier Dulieu,Andreas Osterwalder
  • Publisher : Royal Society of Chemistry
  • Release Date : 2017-12-06
  • Total pages : 670
  • ISBN : 0128098368
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Summary : Recent years have seen tremendous progress in research on cold and controlled molecular collisions, both in theory and in experiment. The advent of techniques to prepare cold and ultracold molecules and ions, to store them in optical lattices or in charged quasicristalline structures, and to use them in crossed or ...

Transition Metals in Coordination Environments

Transition Metals in Coordination Environments
  • Author : Ewa Broclawik,Tomasz Borowski,Mariusz Radoń
  • Publisher : Springer
  • Release Date : 2019-03-16
  • Total pages : 532
  • ISBN : 0128098368
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Summary : 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, ...

Chemical Reactivity in Confined Systems

Chemical Reactivity in Confined Systems
  • Author : Pratim Kumar Chattaraj,Debdutta Chakraborty
  • Publisher : John Wiley & Sons
  • Release Date : 2021-08-13
  • Total pages : 448
  • ISBN : 0128098368
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Summary : An insightful analysis of confined chemical systems for theoretical and experimental scientists Chemical Reactivity in Confined Systems: Theory and Applications presents a theoretical basis for the molecular phenomena observed in confined spaces. The book highlights state-of-the-art theoretical and computational approaches, with a focus on obtaining physically relevant clarification of the ...