Non Covalent Interactions in Quantum Chemistry and Physics

Book Non Covalent Interactions in Quantum Chemistry and Physics Cover

Read or download book entitled Non Covalent Interactions in Quantum Chemistry and Physics written by Alberto Otero de la Roza and published by Elsevier in PDF, EPUB and Kindle Format. Click Get This Book button to download or read online books. Join over 650.000 happy Readers and READ as many books as you like. We cannot guarantee that Non Covalent Interactions in Quantum Chemistry and Physics book is available in the library.

  • Publisher : Elsevier
  • Release : 01 June 2017
  • ISBN : 012809835X
  • Page : 1100 pages
  • Rating : 4.5/5 from 103 voters

Download Non Covalent Interactions in Quantum Chemistry and Physics in PDF, Epub and Kindle

Non-covalent Interactions in Quantum Chemistry and Physics: Theory and Applications provides an entry point for new researchers and a standard reference for researchers publishing in the area of non-covalent interactions. The book puts theory and applications side-by-side and allows the reader to gauge the strengths and weaknesses of different techniques. It 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. Written by the leading experts in this field, the book enables experienced researchers to keep up with the most recent developments, emerging methods, and applications. 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, giving them a single source for study Presents the theoretical foundations of current quantum mechanical methods alongside a collection of examples on how they have been applied to solve practical problems

GET THIS BOOK

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
  • ISBN : 9780128098363
GET THIS BOOKNon-covalent Interactions in Quantum Chemistry and Physics

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

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 : 2017-06-01
  • ISBN : 012809835X
GET THIS BOOKNon-Covalent Interactions in Quantum Chemistry and Physics

Non-covalent Interactions in Quantum Chemistry and Physics: Theory and Applications provides an entry point for new researchers and a standard reference for researchers publishing in the area of non-covalent interactions. The book puts theory and applications side-by-side and allows the reader to gauge the strengths and weaknesses of different techniques. It 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. Written by the leading experts

Noncovalent Forces

Noncovalent Forces
  • Author : Steve Scheiner
  • Publisher : Springer
  • Release Date : 2015-04-16
  • ISBN : 9783319141633
GET THIS BOOKNoncovalent Forces

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 range from very strong (ionic) to very weak (CH--π) interactions. In the intermediate regime, forces to be considered are H-bonds, particularly CH--O and OH--metal, halogen, chalcogen, pnicogen and tetrel bonds,

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
  • ISBN : 9781788014687
GET THIS BOOKNoncovalent Interactions in Catalysis

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 hydrogen bonding is well explored in catalysis, the other types of weak interactions, namely cation-π, anion-π, π-π stacking, pseudo-agostic, halogen, chalcogen, pnictogen, tetrel and icosagen bonds, must also be considered.

Reviews in Computational Chemistry

Reviews in Computational Chemistry
  • Author : Abby L. Parrill,Kenny B. Lipkowitz
  • Publisher : John Wiley & Sons
  • Release Date : 2016-03-09
  • ISBN : 9781119157557
GET THIS BOOKReviews in Computational Chemistry

The Reviews in Computational Chemistry series brings together leading authorities in the field to teach the newcomer and update the expert on topics centered on molecular modeling, such as computer-assisted molecular design (CAMD), quantum chemistry, molecular mechanics and dynamics, and quantitative structure-activity relationships (QSAR). This volume, like those prior to it, features chapters by experts in various fields of computational chemistry. Topics in Volume 29 include: Noncovalent Interactions in Density-Functional Theory Long-Range Inter-Particle Interactions: Insights from Molecular Quantum Electrodynamics (QED) Theory

Non-covalent Interactions

Non-covalent Interactions
  • Author : Pavel Hobza,Klaus Müller-Dethlefs
  • Publisher : Royal Society of Chemistry
  • Release Date : 2010
  • ISBN : 9781847558534
GET THIS BOOKNon-covalent Interactions

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. It is the first monograph on this subject written in close collaboration between a theoretician and an experimentalist which presents a coherent description of non-covalent interactions viewed from these two perspectives. The book describes the experimental and theoretical techniques, and some results obtained by these, which are useful in conveying the

Conjugated Polymers

Conjugated Polymers
  • Author : John R. Reynolds,Barry C. Thompson,Terje A. Skotheim
  • Publisher : CRC Press
  • Release Date : 2019-03-27
  • ISBN : 9781351659802
GET THIS BOOKConjugated Polymers

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 and applications since publication of the previous edition. One of two volumes comprising the comprehensive Handbook, Conjugated Polymers: Perspective, Theory, and New Materials features new chapters on the fundamental theory

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
  • ISBN : 9789400709188
GET THIS BOOKPractical Aspects of Computational Chemistry I

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 on Current Trends in Computational Chemistry (CCTCC)” to which all authors have participated and contributed to its success. This volume poses (and answers) important questions of interest to the computational

Noncovalent Forces

Noncovalent Forces
  • Author : Steve Scheiner
  • Publisher : Springer
  • Release Date : 2016-10-13
  • ISBN : 3319356526
GET THIS BOOKNoncovalent Forces

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 range from very strong (ionic) to very weak (CH--π) interactions. In the intermediate regime, forces to be considered are H-bonds, particularly CH--O and OH--metal, halogen, chalcogen, pnicogen and tetrel bonds,

Handbook of Computational Chemistry

Handbook of Computational Chemistry
  • Author : Jerzy Leszczynski
  • Publisher : Springer Science & Business Media
  • Release Date : 2012-01-14
  • ISBN : 9789400707108
GET THIS BOOKHandbook of Computational Chemistry

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.

Chemical Physics and Quantum Chemistry

Chemical Physics and Quantum Chemistry
  • Author : Anonim
  • Publisher : Academic Press
  • Release Date : 2020-09-18
  • ISBN : 9780128197585
GET THIS BOOKChemical Physics and Quantum Chemistry

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 an exciting combination of themes. Presents surveys of current topics in this rapidly-developing field that has emerged at the cross section of the historically established areas of mathematics, physics, chemistry

Annual Reports in Computational Chemistry

Annual Reports in Computational Chemistry
  • Author : Anonim
  • Publisher : Elsevier
  • Release Date : 2017-08-24
  • ISBN : 9780444639448
GET THIS BOOKAnnual Reports in Computational Chemistry

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 from Electron Propagator Theory, Benchmark databases of intermolecular interaction energies: design, construction, and significance, Gaussian Accelerated Molecular Dynamics: Theory, Implementation and Applications, and Dissociation in Binary Acid/Base Clusters: An

Non-covalent Interactions In Proteins (Second Edition)

Non-covalent Interactions In Proteins (Second Edition)
  • Author : Andrey Karshikoff
  • Publisher : World Scientific
  • Release Date : 2021-11-08
  • ISBN : 9789811228100
GET THIS BOOKNon-covalent Interactions In Proteins (Second Edition)

Although textbooks on the physics of condensed matter consider non-covalent interactions in detail, their application for analysis of protein properties is often poorly presented or omitted. On the other hand, books on biochemistry, molecular modeling or molecular simulation introduce these interactions in the context of the corresponding topic, which sometimes results in superficial explanations of their nature. This book succeeds in uniting comprehensive considerations of non-covalent interactions with the specificity of their application in protein sciences.This second edition includes

Annual Reports in Computational Chemistry

Annual Reports in Computational Chemistry
  • Author : Ralph A. Wheeler
  • Publisher : Newnes
  • Release Date : 2013-09-28
  • ISBN : 9780444626684
GET THIS BOOKAnnual Reports in Computational Chemistry

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 field, each article covers a specific topic of importance to computational chemists. Quantum chemistry Molecular mechanics Force fields Chemical education and applications in academic and industrial settings

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
  • ISBN : 9781351660235
GET THIS BOOKHandbook of Conducting Polymers, Fourth Edition - 2 Volume Set

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 applications. The 4th Edition takes this into account and will be completely rewritten and reorganized, focusing on spin coating, spray coating, blade/slot die coating, layer-by-layer assembly, and fiber spinning