Sinossi
X-ray crystallography provides a unique opportunity to study the arrangement of atoms in a molecule. This book’s modern computer-graphics centered approach facilitates the extrapolation of these valuable observations.
A unified treatment of crystal systems, the book explains how atoms are arranged in crystals using the metric matrix. Featuring two model crystal examples, the text develops theoretical concepts to point and space groups in two dimensions and then extends these ideas to three dimensions.
The book interprets the International Tables for Crystallography to bridge the gap between the crystallographic literature and spatial interatomic relationships. Numerous computer-based exercises are integrated throughout the book, with MATLAB® starter programs that help reduce the minutiae of programming.
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Contenuti
LATTICES Two-Dimensional Lattices
Two-Dimensional Basis Vectors and Unit Cells
Two-Dimensional Transformations between Sets of Basis Vectors
Three-Dimensional Basis Vectors, Unit Cells, and Lattice Transformations
Conversion to Cartesian Coordinates
A Crystal: Hexamethylbenzene
A Crystal: Anhydrous Alum
Effects of Temperature And Pressure On LatticeParameters
UNIT CELL CALCULATIONS
Fractional Coordinates
Plotting Atoms in the Unit Cell
Calculation of Interatomic Bond Distances
Calculation of Interatomic Bond Angles
Area and Volume of the Unit Cell
Summary of Metric Matrix Calculations
Quartz Example
Transformation Matrices
Hexamethylbenzene Example
Crystallographic Directions
Crystallographic Planes and Miller Indices Density
Revisiting Thermal Expansion and Isothermal Compressibility
POINT GROUPS
Group Theory
Symmetry Operations
Crystallographic Rotations
Summary of the Two-Dimensional Crystallographic Operations
Two-Dimensional Crystallographic Point Groups
Two-Dimensional Crystal Systems
Two-Dimensional Point Group Tree
Three-Dimensional Point Groups
Three-Dimensional Crystal Systems
Examples of Three-Dimensional Point Groups With Multiple Generators
Three-Dimensional Point Group Trees
Point Group Symmetry and Some Physical Properties Of Crystals
SPACE GROUPS
Two-Dimensional Bravais Lattices
Crystal Systems and the G Matrices
Two-Dimensional Space Groups
Overview of the Asymmetric Unit
Recipe for Analyzing a Periodic Pattern
Primitive Cells for Cm and C2 mm
Two-Dimensional Space Group Tree
Summary of Two-Dimensional Space Groups
Three-Dimensional Bravais Lattices
Three-Dimensional Space Groups
Hmb and Space Group No. 2, P1
Aa and The Space Group No. 150, P321
THE RECIPROCAL LATTICE
The Reciprocal Lattice
Relationships between Direct and Reciprocal Lattices
Reciprocal Lattice Calculations for Three Crystals
Relationships between Transformation Matrices
Diffraction Pattern and the Reciprocal Lattice
Three Applications of the Reciprocal Lattice
PROPERTIES OF X-RAYS
The Discovery of X-Rays
Properties of Waves
X-Ray Spectrum
The X-Ray Tube
X-Ray Diffraction
ELECTRON DENSITY MAPS
Scattering by an Electron
Scattering by an Atom
Scattering by a Crystal
Some Mathematical Identities
Structure Factors for Some Crystals
Structure Factors for Centrosymmetric Crystals
Electron Density Maps
Product Description
Book by Julian Maureen M
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Foundations of Crystallography With Computer Applications
Da: books4less (Versandantiquariat Petra Gros GmbH & Co. KG), Welling, Germania
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Hardcover-Großformat. Condizione: Gut. 340 Seiten Der Erhaltungszustand des hier angebotenen Werks ist trotz seiner Bibliotheksnutzung sehr sauber. Es befindet sich neben dem Rückenschild lediglich ein Bibliotheksstempel im Buch; ordnungsgemäß entwidmet. In ENGLISCHER Sprache. Sprache: Englisch Gewicht in Gramm: 935. Codice articolo 2140593
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Foundations of Crystallography with Computer Applications
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Hardcover. Condizione: Near Fine. Oversized hardcover, xxvi + 340 pages, colour and b&w illustrations, glossy paper throughout, NOT ex-library. Weight 920g. Interior clean, bright, untanned, firmly bound. Text unmarked, no writing, no highlighting of any kind. Clean and bright outer page edges. Boards mildly shelfworn with gentle scuffing; small creases to upper/lower spine edges. Issued without a dust jacket. -- A comprehensive textbook that integrates the fundamental principles of crystallography with practical computer applications. Designed for students, researchers, and professionals in the fields of chemistry, physics, materials science, and biology, this book provides a thorough grounding in crystallographic theory and practice, enhanced by modern computational techniques. The book is structured to offer a clear and logical progression from basic concepts to advanced topics, ensuring that readers gain a solid understanding of both theoretical and practical aspects of crystallography. It is an essential resource for anyone seeking to understand the atomic structure of materials and the methods used to determine these structures. Key topics covered in this book include: Basic Principles(an introduction to the fundamental concepts of crystallography, including crystal lattices, unit cells, symmetry operations, and space groups); X-ray Diffraction (detailed explanation of X-ray diffraction methods, including the generation and detection of X-rays, diffraction patterns, and the interpretation of these patterns to determine crystal structures); Computational Tools (integration of computer applications in crystallography, featuring software tools and programs use (step-by-step guidance on solving crystal structures, from data collection and processing to structure refinement and validation); Advanced Topics (coverage of more advanced topics such as electron density maps, Fourier transforms, and the use of synchrotron radiation in crystallography); Applications (exploration of the practical applications of crystallography in various scientific fields, including materials science, chemistry, biology, and nanotechnology). The book includes numerous examples, illustrations, and exercises to reinforce learning and facilitate the practical application of crystallographic techniques. Additionally, it provides access to online resources and software tools that allow readers to apply computational methods to real crystallographic problems. "Foundations of Crystallography with Computer Applications" is not only a valuable textbook for students but also a useful reference for researchers and practitioners. By combining theoretical knowledge with hands-on computational skills, this book equips readers with the tools necessary to tackle complex crystallographic challenges and advance their understanding of material structures. Whether you are new to the field or looking to deepen your expertise, this book offers a comprehensive and accessible approach to the fascinating world of crystallography and its applications in science and technology. -- Contents: Ch.1. Lattices; Ch.2. Unit Cell Calculations; Ch.3. Point Groups; Ch.4. Space Groups; Ch.5. The Reciprocal Lattice; Ch.6. Properties of X-rays; Ch.7. Electron Density Maps; References; Bibliography; Appendix; Definitions; Index. Codice articolo 009756
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Foundations of Crystallography with Computer Applications
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