International Tables For Crystallography Definition And Exchange Of Crystallographic Data
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| Author | : Sydney R. Hall |
| Publisher | : Springer Science & Business Media |
| Total Pages | : 609 |
| Release | : 2005-08-19 |
| Genre | : Computers |
| ISBN | : 1402031386 |
International Tables for Crystallography Volume G, Definition and exchange of crystallographic data, describes the standard data exchange and archival file format (the Crystallographic Information File, or CIF) used throughout crystallography. It provides in-depth information vital for small-molecule, inorganic and macromolecular crystallographers, mineralogists, chemists, materials scientists, solid-state physicists and others who wish to record or use the results of a single-crystal or powder diffraction experiment. The volume also provides the detailed data ontology necessary for programmers and database managers to design interoperable computer applications. The accompanying CD-ROM contains the CIF dictionaries in machine-readable form and a collection of libraries and utility programs. This volume is an essential guide and reference for programmers of crystallographic software, data managers handling crystal-structure information and practising crystallographers who need to use CIF.
| Author | : Sydney Hall |
| Publisher | : John Wiley & Sons |
| Total Pages | : 611 |
| Release | : 2005-10-07 |
| Genre | : Science |
| ISBN | : 0470689102 |
International Tables for Crystallography is the definitive resource and reference work for crystallography and structural science. Each of the volumes in the series contains articles and tables of data relevant to crystallographic research and to applications of crystallographic methods in all sciences concerned with the structure and properties of materials. Emphasis is given to symmetry, diffraction methods and techniques of crystal-structure determination, and the physical and chemical properties of crystals. The data are accompanied by discussions of theory, practical explanations and examples, all of which are useful for teaching. Volume G deals with methods and tools for organizing, archiving and retrieving crystallographic data. The volume describes the Crystallographic Information File (CIF), the standard data exchange and archival file format used throughout crystallography. The volume is divided into five parts: Part 1 – An introduction to the development of CIF. Part 2 – Details concepts and specifications of the files and languages. Part 3 – Discusses general considerations when defining a CIF data item and the classification and use of data. Part 4 - Defines all the data names for the core and other dictionaries. Part 5 - Describes CIF applications, including general advice and considerations for programmers. The accompanying software includes the CIF dictionaries in machine-readable form and a collection of libraries and utility programs. Volume G is an essential guide for programmers and data managers handling crystal-structure information, and provides in-depth information vital for recording or using single-crystal or powder diffraction data in small-molecule, inorganic and biological macromolecular structure science. More information on the series can be found at: http://it.iucr.org
| Author | : Dennis W. Bennett |
| Publisher | : John Wiley & Sons |
| Total Pages | : 826 |
| Release | : 2010-03-08 |
| Genre | : Science |
| ISBN | : 3527326774 |
The first textbook for teaching this method to users with little mathematical background logically presents the theory and fundamentals in an easily comprehensible, self-contained way. The result is a must-have for advanced undergraduate students, as well as masters and graduate students and other users of single-crystal X-ray crystallography from many various disciplines.
| Author | : Walter Borchardt-Ott |
| Publisher | : Springer Science & Business Media |
| Total Pages | : 314 |
| Release | : 2012-12-06 |
| Genre | : Science |
| ISBN | : 3662006081 |
As a self-study guide, course primer or teaching aid, Bor- chardt-Ott's Crystallography is the perfect textbook for students and teachers alike. In fact, it can be used by chemists, mineralogists, physicists and geologists. Based on the author's more than 20 years of teaching experience, the book has numerous line drawings designed especially for the text and a large number of exercises - with solutions - at the end of each chapter. The fourth edition of the original German text has been translated into English for an international readership. The heart of the book is firmly fixed in geometrical crystallography. It is from the concept of the space lattice that symmetry operations, Bravais lattices, space groups and point groups are all developed. Molecular symmetry and crystal formsare treated. Much emphasis is placed on the correspondence between point groups and space groups. The sections on crystal chemistry and X-ray diffraction are intended as an introduction to these fields.
| Author | : Yoshio Waseda |
| Publisher | : Springer Science & Business Media |
| Total Pages | : 320 |
| Release | : 2011-03-18 |
| Genre | : Technology & Engineering |
| ISBN | : 3642166350 |
X-ray diffraction crystallography for powder samples is a well-established and widely used method. It is applied to materials characterization to reveal the atomic scale structure of various substances in a variety of states. The book deals with fundamental properties of X-rays, geometry analysis of crystals, X-ray scattering and diffraction in polycrystalline samples and its application to the determination of the crystal structure. The reciprocal lattice and integrated diffraction intensity from crystals and symmetry analysis of crystals are explained. To learn the method of X-ray diffraction crystallography well and to be able to cope with the given subject, a certain number of exercises is presented in the book to calculate specific values for typical examples. This is particularly important for beginners in X-ray diffraction crystallography. One aim of this book is to offer guidance to solving the problems of 90 typical substances. For further convenience, 100 supplementary exercises are also provided with solutions. Some essential points with basic equations are summarized in each chapter, together with some relevant physical constants and the atomic scattering factors of the elements.
| Author | : Robert E. Newnham |
| Publisher | : Oxford University Press |
| Total Pages | : 391 |
| Release | : 2005 |
| Genre | : Science |
| ISBN | : 0198520751 |
Crystals are sometimes called 'Flowers of the Mineral Kingdom'. In addition to their great beauty, crystals and other textured materials are enormously useful in electronics, optics, acoustics and many other engineering applications. This richly illustrated text describes the underlying principles of crystal physics and chemistry, covering a wide range of topics and illustrating numerous applications in many fields of engineering using the most important materials today. Tensors, matrices, symmetry and structure-property relationships form the main subjects of the book. While tensors and matrices provide the mathematical framework for understanding anisotropy, on which the physical and chemical properties of crystals and textured materials often depend, atomistic arguments are also needed to quantify the property coefficients in various directions. The atomistic arguments are partly based on symmetry and partly on the basic physics and chemistry of materials. After introducing the point groups appropriate for single crystals, textured materials and ordered magnetic structures, the directional properties of many different materials are described: linear and nonlinear elasticity, piezoelectricity and electrostriction, magnetic phenomena, diffusion and other transport properties, and both primary and secondary ferroic behavior. With crystal optics (its roots in classical mineralogy) having become an important component of the information age, nonlinear optics is described along with the piexo-optics, magneto-optics, and analogous linear and nonlinear acoustic wave phenomena. Enantiomorphism, optical activity, and chemical anisotropy are discussed in the final chapters of the book.
| Author | : International Union of Pure and Applied Chemistry. Physical and Biophysical Chemistry Division |
| Publisher | : Royal Society of Chemistry |
| Total Pages | : 240 |
| Release | : 2007 |
| Genre | : Reference |
| ISBN | : 0854044337 |
Prepared by the IUPAC Physical Chemistry Division this definitive manual, now in its third edition, is designed to improve the exchange of scientific information among the readers in different disciplines and across different nations. This book has been systematically brought up to date and new sections added to reflect the increasing volume of scientific literature and terminology and expressions being used. The Third Edition reflects the experience of the contributors with the previous editions and the comments and feedback have been integrated into this essential resource. This edition has been compiled in machine-readable form and will be available online.
| Author | : Siegfried Haussühl |
| Publisher | : John Wiley & Sons |
| Total Pages | : 453 |
| Release | : 2008-07-11 |
| Genre | : Science |
| ISBN | : 3527621164 |
Modern semiconductor and laser techniques would be unthinkable today without a highly developed physics of solids. As tailored materials increasingly gain significance, it is more important than ever to understand the basics of crystalline materials and the influence of their symmetry on phenomenological aspects. This first international edition of a classic German standard integrates the latest developments in the field, including two-dimensional crystals and Giant Magneto-Resistance. Its aim is to impart the knowledge necessary to comprehend the manifold peculiarities of crystalline substances in a comprehensive and easily accessible manner. The book devotes much space to a coherent introduction to tensor calculation, making this the first to address the topic in a readily understandable way. Supplemented by 40 exercises with their solutions, this is an ideal textbook for students of physics and chemistry, solid state physicists and chemists, and materials scientists, but also a comprehensive resource for those who wish to get an overview of this important topic.
| Author | : Sydney R. Hall |
| Publisher | : |
| Total Pages | : 0 |
| Release | : 2005 |
| Genre | : Crystallography |
| ISBN | : |
| Author | : Sander Van Smaalen |
| Publisher | : OUP Oxford |
| Total Pages | : 284 |
| Release | : 2007-06-07 |
| Genre | : Science |
| ISBN | : 0191524786 |
For many years it was believed that translational symmetry would be the fundamental property of crystal structures of natural and synthetic compounds. It is now recognised that many compounds crystallise without translational symmetry of their atomic structures. "Incommensurate Crystallography" gives a comprehensive account of the superspace theory for the description of crystal structures and symmetries of these incommensurately modulated crystals and incommensurate composite crystals. It thus provides the necessary background for quantitative analysis of incommensurate crystals by methods in Solid State Chemistry and Solid State Physics. The second half of "Incommensurate Crystallography" is devoted to crystallographic methods of structural analysis of incommensurate compounds. Thorough accounts are given of the diffraction by incommensurate crystals, the choice of parameters in structure refinements, and the use of superspace in analysing crystal structures. The presentation of methods of structure determination includes modern methods like the Maximum Entropy Method and Charge Flipping.
