21st Century Challenges In Chemical Crystallography Ii

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21st Century Challenges in Chemical Crystallography II

Author : D. Michael P. Mingos
Publisher : Springer Nature
ISBN 13 : 3030647471
Total Pages : 240 pages
Book Rating : 4.0/5 (36 download)

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Book Synopsis 21st Century Challenges in Chemical Crystallography II by : D. Michael P. Mingos

Download or read book 21st Century Challenges in Chemical Crystallography II written by D. Michael P. Mingos and published by Springer Nature. This book was released on 2021-01-20 with total page 240 pages. Available in PDF, EPUB and Kindle. Book excerpt: This volume summarises recent developments and highlights new techniques which will define possible future directions for small molecule X-ray crystallography. It provides an insight into how specific aspects of crystallography are developing and shows how they may interact or integrate with other areas of science. The development of more sophisticated equipment and the massive rise in computing power has made it possible to solve the three-dimensional structure of an organic molecule within hours if not minutes. This successful trajectory has resulted in the ability to study ever more complex molecules and use smaller and smaller crystals. The structural parameters for over a million organic and organometallic compounds are now archived in the most commonly used database and this wealth of information creates a new set of problems for future generations of scientists. The volume provides some insight into how users of crystallographic structural data banks can navigate their way through a world where “big data” has become the norm. The coupling of crystallography to quantum chemical calculations provides detailed information about electron distributions in crystals affording a much more detailed analysis of bonding than has been possible previously. In quantum crystallography, quantum mechanical wavefunctions are used to extract information about bonding and properties from the measured X-ray structure factors. The advent of quantum crystallography has resulted in form and structure factors derived from quantum mechanics which have been used in advanced refinement and wavefunction fitting. This volume describes how quantum mechanically derived atomic form factors and structure factors are constructed to allow the improved description of the diffraction experiment. It further discusses recent developments in this field and illustrates their applications with a wide range of examples. This volume will be of interest to chemists and crystallographers with an interest in the synthesis, characterisation and physical and catalytic properties of solid-state materials. It will also be relevant for the community of computational chemists who study chemical systems. Postgraduate students entering the field will benefit from a historical introduction to the way in which scientists have used the data derived from crystallography to develop new structural and bonding models.

21st Century Challenges in Chemical Crystallography I

Author : D. Michael P. Mingos
Publisher : Springer Nature
ISBN 13 : 3030647439
Total Pages : 285 pages
Book Rating : 4.0/5 (36 download)

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Book Synopsis 21st Century Challenges in Chemical Crystallography I by : D. Michael P. Mingos

Download or read book 21st Century Challenges in Chemical Crystallography I written by D. Michael P. Mingos and published by Springer Nature. This book was released on 2021-01-20 with total page 285 pages. Available in PDF, EPUB and Kindle. Book excerpt: This volume summarises recent developments and possible future directions for small molecule X-ray crystallography. It reviews specific areas of crystallography which are rapidly developing and places them in a historical context. The interdisciplinary nature of the technique is emphasised throughout. It introduces and describes the chemical crystallographic and synchrotron facilities which have been at the cutting edge of the subject in recent decades. The introduction of new computer-based algorithms has proved to be very influential and stimulated and accelerated the growth of new areas of science. The challenges which will arise from the acquisition of ever larger databases are considered and the potential impact of artificial intelligence techniques stressed. Recent advances in the refinement and analysis of X-ray crystal structures are highlighted. In addition the recent developments in time resolved single crystal X-ray crystallography are discussed. Recent years have demonstrated how this technique has provided important mechanistic information on solid-state reactions and complements information from traditional spectroscopic measurements. The volume highlights how the prospect of being able to routinely “watch” chemical processes as they occur provides an exciting possibility for the future. Recent advances in X-ray sources and detectors that have also contributed to the possibility of dynamic single-crystal X-ray diffraction methods are presented. The coupling of crystallography and quantum chemical calculations provides detailed information about electron distributions in crystals and has resulted in a more detailed understanding of chemical bonding. The volume will be of interest to chemists and crystallographers with an interest in the synthesis, characterisation and physical and catalytic properties of solid-state materials. Postgraduate students entering the field will benefit from a historical introduction to the subject and a description of those techniques which are currently used. Since X-ray crystallography is used so widely in modern chemistry it will serve to alert senior chemists to those developments which will become routine in coming decades. It will also be of interest to the broad community of computational chemists who study chemical systems.

21st Century Challenges in Chemical Crystallography

Author : D. M. P. Mingos
Publisher :
ISBN 13 : 9783030647483
Total Pages : pages
Book Rating : 4.6/5 (474 download)

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Book Synopsis 21st Century Challenges in Chemical Crystallography by : D. M. P. Mingos

Download or read book 21st Century Challenges in Chemical Crystallography written by D. M. P. Mingos and published by . This book was released on 2020 with total page pages. Available in PDF, EPUB and Kindle. Book excerpt: "This volume summarises recent developments and highlights new techniques which will define possible future directions for small molecule X-ray crystallography. It provides an insight into how specific aspects of crystallography are developing and shows how they may interact or integrate with other areas of science.The development of more sophisticated equipment and the massive rise in computing power has made it possible to solve the three-dimensional structure of an organic molecule within hours if not minutes. This successful trajectory has resulted in the ability to study ever more complex molecules and use smaller and smaller crystals. The structural parameters for over a million organic and organometallic compounds are now archived in the most commonly used database and this wealth of information creates a new set of problems for future generations of scientists. The volume provides some insight into how users of crystallographic structural data banks can navigate their way through a world where “big data” has become the norm. The coupling of crystallography to quantum chemical calculations provides detailed information about electron distributions in crystals affording a much more detailed analysis of bonding than has been possible previously. In quantum crystallography, quantum mechanical wavefunctions are used to extract information about bonding and properties from the measured X-ray structure factors. The advent of quantum crystallography has resulted in form and structure factors derived from quantum mechanics which have been used in advanced refinement and wavefunction fitting. This volume describes how quantum mechanically derived atomic form factors and structure factors are constructed to allow the improved description of the diffraction experiment. It further discusses recent developments in this field and illustrates their applications with a wide range of examples.This volume will be of interest to chemists and crystallographers with an interest in the synthesis, characterisation and physical and catalytic properties of solid-state materials. It will also be relevant for the community of computational chemists who study chemical systems. Postgraduate students entering the field will benefit from a historical introduction to the way in which scientists have used the data derived from crystallography to develop new structural and bonding models."--

50th Anniversary of Electron Counting Paradigms for Polyhedral Molecules

Author : D. Michael P. Mingos
Publisher : Springer Nature
ISBN 13 : 3030848639
Total Pages : 255 pages
Book Rating : 4.0/5 (38 download)

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Book Synopsis 50th Anniversary of Electron Counting Paradigms for Polyhedral Molecules by : D. Michael P. Mingos

Download or read book 50th Anniversary of Electron Counting Paradigms for Polyhedral Molecules written by D. Michael P. Mingos and published by Springer Nature. This book was released on 2022-01-01 with total page 255 pages. Available in PDF, EPUB and Kindle. Book excerpt: The 50 Year Anniversary of the development of electron counting paradigms for polyhedral molecules is celebrated in two volumes of Structure and Bonding. Volume 1 covers the historical development, theoretical models and applications to boranes and metalloboranes.

Improving and Tailoring Enzymes for Food Quality and Functionality

Author : Rickey Y. Yada
Publisher : Elsevier
ISBN 13 : 0443154384
Total Pages : 380 pages
Book Rating : 4.4/5 (431 download)

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Book Synopsis Improving and Tailoring Enzymes for Food Quality and Functionality by : Rickey Y. Yada

Download or read book Improving and Tailoring Enzymes for Food Quality and Functionality written by Rickey Y. Yada and published by Elsevier. This book was released on 2024-04-01 with total page 380 pages. Available in PDF, EPUB and Kindle. Book excerpt: Improving and Tailoring Enzymes for Food Quality and Functionality, Second Edition covers the most relevant information demanded in the production, engineering, and application of enzymes. The title is very detailed and is in the important cross-field of academia and industry. This totally revised new edition covers a broad range of topics related to enzymes and their use in food, presenting both the fundamental theory and practical application, updated with interesting novel information on biosensors, waste, valorization, up-cycling and engineering perspectives, besides an increased focus on sustainability. Thoroughly updated revision covering a broad range of topics related to enzymes and their use in the food industry Presents both the fundamental theory and recent examples from the literature, including the fundamentals of protein folding and enzyme catalysis, the preparation of enzymes from natural and recombinant sources, immobilizing enzymes, and a range of specific food applications Covers new research directions in enzymes, thus helping those trying to solve a technical issue or develop a new product

New Electron Correlation Methods and their Applications, and Use of Atomic Orbitals with Exponential Asymptotes

Author :
Publisher : Academic Press
ISBN 13 : 0128235470
Total Pages : 354 pages
Book Rating : 4.1/5 (282 download)

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Book Synopsis New Electron Correlation Methods and their Applications, and Use of Atomic Orbitals with Exponential Asymptotes by :

Download or read book New Electron Correlation Methods and their Applications, and Use of Atomic Orbitals with Exponential Asymptotes written by and published by Academic Press. This book was released on 2021-09-28 with total page 354 pages. Available in PDF, EPUB and Kindle. Book excerpt: 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 and biology Features detailed reviews written by leading international researchers

Solid State Chemistry

Author : Elaine A. Moore
Publisher : CRC Press
ISBN 13 : 0429648669
Total Pages : 426 pages
Book Rating : 4.4/5 (296 download)

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Book Synopsis Solid State Chemistry by : Elaine A. Moore

Download or read book Solid State Chemistry written by Elaine A. Moore and published by CRC Press. This book was released on 2020-08-03 with total page 426 pages. Available in PDF, EPUB and Kindle. Book excerpt: "A comprehensive guide to solid-state chemistry which is ideal for all undergraduate levels. It covers well the fundamentals of the area, from basic structures to methods of analysis, but also introduces modern topics such as sustainability." Dr. Jennifer Readman, University of Central Lancashire, UK "The latest edition of Solid State Chemistry combines clear explanations with a broad range of topics to provide students with a firm grounding in the major theoretical and practical aspects of the chemistry of solids." Professor Robert Palgrave, University College London, UK Building a foundation with a thorough description of crystalline structures, this fifth edition of Solid State Chemistry: An Introduction presents a wide range of the synthetic and physical techniques used to prepare and characterise solids. Going beyond this, this largely nonmathematical introduction to solid-state chemistry includes the bonding and electronic, magnetic, electrical, and optical properties of solids. Solids of particular interest—porous solids, superconductors, and nanostructures—are included. Practical examples of applications and modern developments are given. It offers students the opportunity to apply their knowledge in real-life situations and will serve them well throughout their degree course. New in the Fifth Edition A companion website which offers accessible resources for students and instructors alike, featuring topics and tools such as quizzes, videos, web links and more A new chapter on sustainability in solid-state chemistry written by an expert in this field Cryo-electron microscopy X-ray photoelectron spectroscopy (ESCA) Covalent organic frameworks Graphene oxide and bilayer graphene Elaine A. Moore studied chemistry as an undergraduate at Oxford University and then stayed on to complete a DPhil in theoretical chemistry with Peter Atkins. After a two-year postdoctoral position at the University of Southampton, she joined the Open University in 1975, becoming a lecturer in chemistry in 1977, senior lecturer in 1998, and reader in 2004. She retired in 2017 and currently has an honorary position at the Open University. She has produced OU teaching texts in chemistry for courses at levels 1, 2, and 3 and written texts in astronomy at level 2 and physics at level 3. She was team leader for the production and presentation of an Open University level 2 chemistry module delivered entirely online. She is a Fellow of the Royal Society of Chemistry and a Senior Fellow of the Higher Education Academy. She was co-chair for the successful Departmental submission of an Athena Swan bronze award. Lesley E. Smart studied chemistry at Southampton University, United Kingdom. After completing a PhD in Raman spectroscopy, she moved to a lectureship at the (then) Royal University of Malta. After returning to the United Kingdom, she took an SRC Fellowship to Bristol University to work on X-ray crystallography. From 1977 to 2009, she worked at the Open University chemistry department as a lecturer, senior lecturer, and Molecular Science Programme director, and she held an honorary senior lectureship there until her death in 2016. At the Open University, she was involved in the production of undergraduate courses in inorganic and physical chemistry and health sciences. She served on the Council of the Royal Society of Chemistry and as the chair of their Benevolent Fund.

The Handbook of Medicinal Chemistry: Principles and Practice

Author : Simon E Ward
Publisher : Royal Society of Chemistry
ISBN 13 : 1788018982
Total Pages : 1051 pages
Book Rating : 4.7/5 (88 download)

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Book Synopsis The Handbook of Medicinal Chemistry: Principles and Practice by : Simon E Ward

Download or read book The Handbook of Medicinal Chemistry: Principles and Practice written by Simon E Ward and published by Royal Society of Chemistry. This book was released on 2023-02-03 with total page 1051 pages. Available in PDF, EPUB and Kindle. Book excerpt: The 2nd edition of The Handbook of Medicinal Chemistry is a carefully curated compilation of writing from global experts. Using their broad experience of medicinal chemistry, project leadership and drug discovery from both industry, academic and charity perspectives they are able to provide unparalleled insight into the field in a single, invaluable volume.

Physical Chemistry

Author : A.D. Buckingham
Publisher :
ISBN 13 :
Total Pages : pages
Book Rating : 4.:/5 (929 download)

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Book Synopsis Physical Chemistry by : A.D. Buckingham

Download or read book Physical Chemistry written by A.D. Buckingham and published by . This book was released on 1975 with total page pages. Available in PDF, EPUB and Kindle. Book excerpt:

Problems in Structural Inorganic Chemistry

Author : Wai-Kee Li
Publisher :
ISBN 13 : 0198823908
Total Pages : 470 pages
Book Rating : 4.1/5 (988 download)

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Book Synopsis Problems in Structural Inorganic Chemistry by : Wai-Kee Li

Download or read book Problems in Structural Inorganic Chemistry written by Wai-Kee Li and published by . This book was released on 2019 with total page 470 pages. Available in PDF, EPUB and Kindle. Book excerpt: This textbook offers over 400 problems and solutions in structural inorganic chemistry for senior undergraduates and beginning graduates. It is an updated companion text to Advanced Structural Inorganic Chemistry by the same authors. The new edition adds over 100 new problems and three new chapters on metal compounds and bioinorganic chemistry.

Physical Chemistry

Author :
Publisher :
ISBN 13 : 9780408706100
Total Pages : pages
Book Rating : 4.7/5 (61 download)

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Book Synopsis Physical Chemistry by :

Download or read book Physical Chemistry written by and published by . This book was released on 1975 with total page pages. Available in PDF, EPUB and Kindle. Book excerpt:

Beyond the Molecular Frontier

Author : National Research Council
Publisher : National Academies Press
ISBN 13 : 0309168392
Total Pages : 238 pages
Book Rating : 4.3/5 (91 download)

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Book Synopsis Beyond the Molecular Frontier by : National Research Council

Download or read book Beyond the Molecular Frontier written by National Research Council and published by National Academies Press. This book was released on 2003-03-19 with total page 238 pages. Available in PDF, EPUB and Kindle. Book excerpt: Chemistry and chemical engineering have changed significantly in the last decade. They have broadened their scopeâ€"into biology, nanotechnology, materials science, computation, and advanced methods of process systems engineering and controlâ€"so much that the programs in most chemistry and chemical engineering departments now barely resemble the classical notion of chemistry. Beyond the Molecular Frontier brings together research, discovery, and invention across the entire spectrum of the chemical sciencesâ€"from fundamental, molecular-level chemistry to large-scale chemical processing technology. This reflects the way the field has evolved, the synergy at universities between research and education in chemistry and chemical engineering, and the way chemists and chemical engineers work together in industry. The astonishing developments in science and engineering during the 20th century have made it possible to dream of new goals that might previously have been considered unthinkable. This book identifies the key opportunities and challenges for the chemical sciences, from basic research to societal needs and from terrorism defense to environmental protection, and it looks at the ways in which chemists and chemical engineers can work together to contribute to an improved future.

23rd Annual Conference of the German Crystallographic Society, March 16–19, 2015, Göttingen, Germany

Author :
Publisher : Walter de Gruyter GmbH & Co KG
ISBN 13 : 3110415372
Total Pages : 156 pages
Book Rating : 4.1/5 (14 download)

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Book Synopsis 23rd Annual Conference of the German Crystallographic Society, March 16–19, 2015, Göttingen, Germany by :

Download or read book 23rd Annual Conference of the German Crystallographic Society, March 16–19, 2015, Göttingen, Germany written by and published by Walter de Gruyter GmbH & Co KG. This book was released on 2015-04-28 with total page 156 pages. Available in PDF, EPUB and Kindle. Book excerpt: Zeitschrift für Kristallographie. Supplement Volume 35 presents the complete Abstracts of all contributions to the 23rd Annual Conference of the German Crystallographic Society in Göttingen (Germany) 2015: - Plenary Talks - Microsymposia - Poster Session Supplement Series of Zeitschrift für Kristallographie publishes Abstracts of international conferences on the interdisciplinary field of crystallography.

Applications of Density Functional Theory to Biological and Bioinorganic Chemistry

Author : Mihai V. Putz
Publisher : Springer
ISBN 13 : 3642327508
Total Pages : 245 pages
Book Rating : 4.6/5 (423 download)

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Book Synopsis Applications of Density Functional Theory to Biological and Bioinorganic Chemistry by : Mihai V. Putz

Download or read book Applications of Density Functional Theory to Biological and Bioinorganic Chemistry written by Mihai V. Putz and published by Springer. This book was released on 2013-02-01 with total page 245 pages. Available in PDF, EPUB and Kindle. Book excerpt: The series Structure and Bonding publishes critical reviews on topics of research concerned with chemical structure and bonding. The scope of the series spans the entire Periodic Table and addresses structure and bonding issues associated with all of the elements. It also focuses attention on new and developing areas of modern structural and theoretical chemistry such as nanostructures, molecular electronics, designed molecular solids, surfaces, metal clusters and supramolecular structures. Physical and spectroscopic techniques used to determine, examine and model structures fall within the purview of Structure and Bonding to the extent that the focus is on the scientific results obtained and not on specialist information concerning the techniques themselves. Issues associated with the development of bonding models and generalizations that illuminate the reactivity pathways and rates of chemical processes are also relevant. The individual volumes in the series are thematic. The goal of each volume is to give the reader, whether at a university or in industry, a comprehensive overview of an area where new insights are emerging that are of interest to a larger scientific audience. Thus each review within the volume critically surveys one aspect of that topic and places it within the context of the volume as a whole. The most significant developments of the last 5 to 10 years should be presented using selected examples to illustrate the principles discussed. A description of the physical basis of the experimental techniques that have been used to provide the primary data may also be appropriate, if it has not been covered in detail elsewhere. The coverage need not be exhaustive in data, but should rather be conceptual, concentrating on the new principles being developed that will allow the reader, who is not a specialist in the area covered, to understand the data presented. Discussion of possible future research directions in the area is welcomed. Review articles for the individual volumes are invited by the volume editors. Readership: research scientists at universities or in industry, graduate students Special offer For all customers who have a standing order to the print version of Structure and Bonding, we offer free access to the electronic volumes of the Series published in the current year via SpringerLink.

Structure of Materials

Author : Marc De Graef
Publisher : Cambridge University Press
ISBN 13 : 1139560476
Total Pages : 773 pages
Book Rating : 4.1/5 (395 download)

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Book Synopsis Structure of Materials by : Marc De Graef

Download or read book Structure of Materials written by Marc De Graef and published by Cambridge University Press. This book was released on 2012-10-08 with total page 773 pages. Available in PDF, EPUB and Kindle. Book excerpt: This highly readable, popular textbook for upper undergraduates and graduates comprehensively covers the fundamentals of crystallography and symmetry, applying these concepts to a large range of materials. New to this edition are more streamlined coverage of crystallography, additional coverage of magnetic point group symmetry and updated material on extraterrestrial minerals and rocks. New exercises at the end of chapters, plus over 500 additional exercises available online, allow students to check their understanding of key concepts and put into practice what they have learnt. Over 400 illustrations within the text help students visualise crystal structures and more abstract mathematical objects, supporting more difficult topics like point group symmetries. Historical and biographical sections add colour and interest by giving an insight into those who have contributed significantly to the field. Supplementary online material includes password-protected solutions, over 100 crystal structure data files, and Powerpoints of figures from the book.

Chemical Crystallography. an Introduction to Optical and X-ray Methods. 2nd Pr

Author : C.W. Bunn
Publisher :
ISBN 13 :
Total Pages : 434 pages
Book Rating : 4.:/5 (841 download)

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Book Synopsis Chemical Crystallography. an Introduction to Optical and X-ray Methods. 2nd Pr by : C.W. Bunn

Download or read book Chemical Crystallography. an Introduction to Optical and X-ray Methods. 2nd Pr written by C.W. Bunn and published by . This book was released on 1946 with total page 434 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Crystallography for Chemists

Author : Phillip E. Fanwick
Publisher : Cambridge Scholars Publishing
ISBN 13 : 1527534138
Total Pages : 245 pages
Book Rating : 4.5/5 (275 download)

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Book Synopsis Crystallography for Chemists by : Phillip E. Fanwick

Download or read book Crystallography for Chemists written by Phillip E. Fanwick and published by Cambridge Scholars Publishing. This book was released on 2019-05-03 with total page 245 pages. Available in PDF, EPUB and Kindle. Book excerpt: For the last fifty years, X-ray crystallography and allied methods have been one of the most important analytical techniques for chemical analysis. With improved equipment, computers, and programs, the time required for such determinations has been reduced from months to hours. However, crystallography has never found its way into chemical education. There are many reasons for this failure, but the result has been most chemists having little understanding of the method beyond operating equipment and running black box programs. This book provides a basic education on crystallographic methods. As much as possible, it is non-mathematical, and written in language that chemists use. It is designed for the instruction of senior undergraduate students and beginning graduate students, but will also be of interest to any chemist who has had no instruction in crystallography. Much of the book provides information that can be used by chemists who do not plan to conduct crystallographic studies themselves.