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Books > Science & Mathematics > Chemistry > Crystallography
The question of what is matter has fascinated the human race for thousands of years, and continues to fascinate us today: what is it made of, and how does it behave? Early in our history, the character of natural materials was of critical importance to us, and it is no accident that we date the prehistory of humanity by the materials with which our predecessors made their tools. Tools are one of the more enduring creations of our prehistoric ancestors, and are of particular historical significance as they document the increasing technological sophistication of the human race. From the Stone Age to the Bronze Age to the Iron Age, there was an increasing awareness of the diversity of natural materials, how they could be used, and eventually, how they could be processed in order to provide even more technologically effective materials for our use. This increasing reliance on rocks and minerals required that more and more people be conversant with these materials and their properties. The atomistic theory of the Greeks was a solely philosophical construct, and further development had to await a more sophisticated approach to Science. The first steps in this direction were taken by who else but Isaac Newton (1643-1727 AD). Although his ideas on action at a distance initially referred to planets, he also considered them as applying to atoms, and concluded from physical evidence involving surface tension and viscosity that there must be strong attractions between atoms. In what must be considered as insight of legendary proportions, Roger Joseph Boscovich (1711-1787), a Jesuit mathematician from Croatia, proposed that at very short distances, atoms repulse each other, the repulsion increasing indefinitely as the particles become closer together, whereas at longer distances apart, atoms oscillate between attraction and repulsion. Frank Hawthorne uses the republication of this set of landmark papers as a vehicle to focus on the development of key issues concerning structural connectivity in inorganic solids, of which minerals are a key component, and to look at where we are today in our understanding of crystal structure.
Understandable by anyone concerned with crystals or solid state properties dependent on structure Presents a general system using simple notation to reveal similarities and differences among crystal structures More than 300 selected and prepared figures illustrate structures found in thousands of compounds Includes a CD-ROM with CrystalMakerTM data files to allow the reader to view and manipulate the structures
Crystallography Made Crystal Clear makes crystallography accessible
to readers who have no prior knowledge of the field or its
mathematical basis. This is the most comprehensive and concise
reference for beginning Macromolecular crystallographers, written
by a leading expert in the field. Rhodes' uses visual and geometric
models to help readers understand the mathematics that form the
basis of x-ray crystallography. He has invested a great deal of
time and effort on World Wide Web tools for users of models,
including beginning-level tutorials in molecular modeling on
personal computers. Rhodes' personal CMCC Home Page also provides
access to tools and links to resources discussed in the text. Most
significantly, the final chapter introduces the reader to
macromolecular modeling on personal computers-featuring
SwissPdbViewer, a free, powerful modeling program now available for
PC, Power Macintosh, and Unix computers. This updated and expanded
new edition uses attractive four-color art, web tool access for
further study, and concise language to explain the basis of X-ray
crystallography, increasingly vital in today's research labs.
Experimental and theoretical aspects of crystal growth and its applications, e.g. in devices, are within the scope of these new books. Experimental and theoretical contributions are included in the following fields: theory of nucleation and growth, molecular kinetics and transport phenomena, crystallisation in viscous media such as polymers and glasses; crystal growth of metals, minerals, semiconductors, superconductors, magnetics, inorganic, organic and biological substances in bulk or as thin films; molecular beam epitaxy, chemical vapour deposition, growth of III-V and II-VI and other semiconductors; characterisation of single crystals by physical and chemical methods; apparatus, instrumentation and techniques for crystal growth, and purification methods; and multilayer heterostructures and their characterisation with an emphasis on crystal growth and epitaxial aspects of electronic materials.
New Developments In Crystal Growth
Structure and Dynamics of Macromolecules: Absorption and
Fluorescence Studies is clearly written and contains invaluable
examples, coupled with illustrations that demonstrate a
comprehensible analysis and presentation of the data. This book
offers practical information on the fundamentals of absorption and
fluorescence, showing that it is possible to interpret the same
result in different ways. It is an asset to students, professors
and researchers wishing to discover or use absorption and
fluorescence spectroscopy, and to scientists working on the
structure and dynamics of macromolecules.
There is no question that the field of solid state electronics,
which essentially began with work at Bell laboratories just after
World War II, has had a profound impact on today's Society. What is
not nearly so widely known is that advances in the art and science
of crystal growth underpin this technology. Single crystals, once
valued only for their beauty, are now found, in one form or another
in most electronic, optoelectronic and numerous optical devices.
These devices, in turn, have permeated almost every home and
village throughout the world. In fact it is hard to imagine what
our electronics industry, much less our entire civilization, would
have been like if crystal growth scientists and engineers were
unable to produce the large, defect free crystals required by
device designers.
Crystals are the unacknowledged pillars of modern technology. The
modern technological developments depend greatly on the
availability of suitable single crystals, whether it is for lasers,
semiconductors, magnetic devices, optical devices, superconductors,
telecommunication, etc. In spite of great technological
advancements in the recent years, we are still in the early stage
with respect to the growth of several important crystals such as
diamond, silicon carbide, PZT, gallium nitride, and so on. Unless
the science of growing these crystals is understood precisely, it
is impossible to grow them as large single crystals to be applied
in modern industry.
This book is designed to help those with little or no background in the field of defect chemistry to apply its principles and to interpret the related behaviour of materials. It is the product of a course for advanced undergraduates and graduate students that the author taught at Lehigh University for over twenty years. The course is highly interdisciplinary and has been attended by students from the departments of chemical engineering, chemistry, electrical engineering, computer science, geology, materials science and engineering, and physics. The book is intended for use either as a text on such a course, or as a reference work that covers the major principles of defect chemistry.
There have been several recent breakthroughs in the supramolecular domain: larger molecular components are being synthesized; 2D layers involving multiple recognition sites; crystals with intricate building blocks are being designed; more components are being used in assembly and self-assembly "algorithms" (some having molecular weights as high as 15,000); and there is an increasing versatility in applications. The difficulty in characterizing and obtaining structural information on such large assemblies has increased to such a level that no single technique is now adequate. Various methods have now been upgraded and are being combined: X-ray diffraction (structures with hundreds of independent atoms), NMR, AFM/STM (manipulation of a single molecule), FAB/MS, time-resolved techniques up to the picosecond range, new computational approaches, and others. The present book aims to shed light on the most recent developments in both the synthesis of novel assemblies and on current methods for their characterization.
This book is by far the most comprehensive treatment of point and space groups, and their meaning and applications. Its completeness makes it especially useful as a text, since it gives the instructor the flexibility to best fit the class and goals. The instructor, not the author, decides what is in the course. And it is the prime book for reference, as material is much more likely to be found in it than in any other book; it also provides detailed guides to other sources.Much of what is taught is folklore, things everyone knows are true, but (almost?) no one knows why, or has seen proofs, justifications, rationales or explanations. (Why are there 14 Bravais lattices, and why these? Are the reasons geometrical, conventional or both? What determines the Wigner-Seitz cells? How do they affect the number of Bravais lattices? Why are symmetry groups relevant to molecules whose vibrations make them unsymmetrical? And so on). Here these analyses are given, interrelated, and in-depth. The understanding so obtained gives a strong foundation for application and extension. Assumptions and restrictions are not merely made explicit, but also emphasized.In order to provide so much information, details and examples, and ways of helping readers learn and understand, the book contains many topics found nowhere else, or only in obscure articles from the distant past. The treatment is (often completely) different from those elsewhere. At least in the explanations, and usually in many other ways, the book is completely new and fresh. It is designed to inform, educate and make the reader think. It strongly emphasizes understanding.The book can be used at many levels, by many different classes of readers - from those who merely want brief explanations (perhaps just of terminology), who just want to skim, to those who wish the most thorough understanding. remove remove
This proceedings volume contains research data on structural investigation of materials of high industrial value. In particular, the following issues are discussed: phase characterization by diffraction methods, application of direct methods for solving crystal structure from powder diffraction, electron crystallography, Rietveld method application, defects and substructure analysis in materials, new X-ray methods, small angle scattering studies of crystalline and amorphous solids, phase transformation studies including crystallography of the reversible martensitic transformation, structure of noncrystalline materials, structure and properties of new materials.
Intended for researchers and students in physics, chemistry and materials science, this work aims to provide the necessary background information and sufficient mathematical and physical detail to study research literature in nuclear magnetic resonance studies of liquid crystals. This second edition, updated throughout, incorporates many new references, corrects typographical errors, and includes new mathematical appendices.
(2 Volume set). The valuable information in Pearson's Handbook is now more affordable in a handy desk reference. 27,686 entries of the highest quality crystal data, representing 27,686 different compounds. Structure type given for all entries. 54 per cent of entries include the coordinates of the atoms. 605 entries are 'filled-up' structure 1,730 structure types have been assigned by the editor 6,426 belong to berthollide compounds. Data included up to 1995 (6-year update to the Second Edition 12-year update to the First Edition). Full 167-page structure-type index (with all its representatives). Entries include full information, as in the Second Edition. Comprises all the international literature from 1913 to 1995. Includes detailed crystallographic data for unary, binary and ternary phases, excluding halides and ternary (or quaternary) oxides. Fully revised and updated. Covers more than 27,000 compounds, with all data critically evaluated. Includes the following improvements over the original Pearson's.Additional literature years between 1989 to 1995 have been covered completely and comprehensively, based on searches of more than 130 journals and more than 10,000 abstract pages per year. Entries contain additional information, such as calculated density, color, more detailed diffraction data, standard deviation of unit cell dimension(s), point-set symmetry, and full reference, including publication title. All entries and structure types have been computer checked for consistency and correctness. All crystallographic data are now given in the standard setting according to the International Tables for Crystallography. Include a Six-Year Update of the Data in The Second Edition.
The Lectures: Conjugated Polymers in Layered Hosts; M.G. Kanatzidis, et al. Staging in Intercalated Graphites, Polymers, and Fullerenes; E.J. Mele. Seminars and Communications: Size-Mismatch Melting in Two Dimensions; N. Mousseau, M.F. Thorpe. Tight Binding Molecular Dynamics for Intercalation Chemistry; M. Menon, et al. Local Oscillator Model for Superconducting Fullerenes; Z. Gedik, S. Ciraci. Some Optical Properties of Fullerenes; B. Friedman. Photoluminescence of Solid State Fullerenes; H.J. Byrne, et al. Magnetic Properties of Alkali Metal Intercalated Fullerides; P. Byszewski, et al. Charge Transport and Percolation in Conducting Polymers; J. Voit. Overview on the Chemistry of Intercalation in Graphite of Binary Metallic Alloys; P. Lagrange. Mineralomimetic Inclusion Behavior of Cadmium Cyanide Systems; T. Iwamoto, et al. 36 additional articles. Index.
Hardbound. The apatites and related calcium phosphates have been of considerable interest to biologists, mineralogists, and inorganic and industrial chemists for many years. This book contains a detailed description of the structures and structural interrelationships of the calcium orthophosphates, including the apatites. Their preparation, crystal growth and dissolution, chemical reactions including thermal decomposition, IR, Raman and NMR spectra and various physical properties are discussed. Apatites other than those containing calcium and phosphorus are included. Synthetic, mineral and biological carbonate apatites are also considered. A wide, but critical coverage of the literature is given, which includes a substantial amount not written in English. Research from many disciplines is included which results in a comprehensive compilation of recent work.
This book contains the contributions of 13 well known specialists in the field of solid state chemistry who had been invited as lecturers at a 1992 NATO Advanced Study Institute in Erice, Sicily. The chapters of a more general character concern the use of the space group - subgroup relationships for the recognition of structure families, the crystal chemical formulae (which is a way of denoting simple crystal chemical information in a condensed form), the concepts of atom co-ordination, atom volume and charge transfer and the physicist's view of the bond strength in the solid which is measured by the crystal orbital overlap population. It is demonstrated for the case of ionic compounds that the bond valence method is superior to the old sum-of-radii method for the prediction of interatomic distances. Simple valence electron rules can be applied fto compounds with tetrahedral anion complexes. These rules allow one not only to make predictions on expected structural features of unknown compounds, but also to point out inconsistencies between the reported structure and composition of known compounds. Detailed accounts are presented on the crystal chemistry of the superconducting copper oxides, the sulfosalts, the metal cluster compounds, the silicates and the transition metal borides and related compounds. In the case of intermetalic compounds the intergrowth concept is found to be very useful for an "understanding" of complicated atom arrangements. At the end of each chapter there can be found problems and their solutions. This makes it possible for (advanced) undergraduates in chemistry, physics, metallurgy, materials science and mineralogy to be able to profit from a study of this book.
The pharmaceutical industry has become acutely aware of the importance of the solid state, but pharmaceutical scientists often lack specific training in topics related to solid-state structure and crystallography. This book provides needed support in this topical area. Taking an intuitive and informal approach to solid-state structure and crystallographic concepts, this book is written for anyone who needs a clear understanding of modern crystallography, with specific reference to small-molecule pharmaceutical solids. The author describes molecular crystals and crystal structures, symmetry, space groups, single-crystal and powder X-ray diffraction techniques and the analysis and interpretation of crystallographic data. Useful technical details are presented where necessary and case studies from the pharmaceutical literature put theory into a practical context. Written by an internationally leading figure and with its focus on molecular crystals, this book is equally applicable to chemists with a need to understand and apply X-ray crystal-structure determination.
This classic text of elementary dislocation theory has been reprinted to fulfil persistent demand. Yet because it approaches elementary dislocation theory from its most basic level, the material contained in the volume is as up-to-date as when first published. The text addresses topics which are fundamental to the theory of dislocation behaviour, such as Burgers vectors and internal stresses of dislocations.
Protein crystallography has become vital to further understanding the structure and function of many complex biological systems. In recent years, structure determination has progressed tremendously however the quality of crystals and data sets can prevent the best results from being obtained. With contributions from world leading researchers whose software are used worldwide, this book provides a coherent approach on how to handle difficult crystallographic data and how to assess its quality. The chapters will cover all key aspects of protein crystallography, from instrumentation and data processing through to model building. This book also addresses challenges that protein crystallographers will face such as dealing with data from microcrystals and multi protein complexes. This book is ideal for both academics and researchers in industry looking for a comprehensive guide to protein crystallography.
Small-angle scattering of X-rays (SAXS) and neutrons (SANS) is an established method for the structural characterization of biological objects in a broad size range from individual macromolecules (proteins, nucleic acids, lipids) to large macromolecular complexes. SAXS/SANS is complementary to the high resolution methods of X-ray crystallography and nuclear magnetic resonance, allowing for hybrid modeling and also accounting for available biophysical and biochemical data. Quantitative characterization of flexible macromolecular systems and mixtures has recently become possible. SAXS/SANS measurements can be easily performed in different conditions by adding ligands or binding partners, and by changing physical and/or chemical characteristics of the solvent to provide information on the structural responses. The technique provides kinetic information about processes like folding and assembly and also allows one to analyze macromolecular interactions. The major factors promoting the increasingly active use of SAXS/SANS are modern high brilliance X-ray and neutron sources, novel data analysis methods, and automation of the experiment, data processing and interpretation. In this book, following the presentation of the basics of scattering from isotropic macromolecular solutions, modern instrumentation, experimental practice and advanced analysis techniques are explained. Advantages of X-rays (rapid data collection, small sample volumes) and of neutrons (contrast variation by hydrogen/deuterium exchange) are specifically highlighted. Examples of applications of the technique to different macromolecular systems are considered with specific emphasis on the synergistic use of SAXS/SANS with other structural, biophysical and computational techniques.
Concise, logical, and mathematically rigorous, this introduction to the theory of dislocations is addressed primarily to students and researchers in the general areas of mechanics and applied mathematics. Its scope encompasses those aspects of dislocation theory which are closely related to the theories of elasticity and macroscopic plasticity, to modern continuum mechanics, and to the theory of cracks and fracture. The volume incorporates several new and original pieces of work, including a development of the theory of dislocation motion and plastic strain for non-linear materials, a new discussion of the line tension model, revised calculations of the Peierls resistance, and a new development of the van der Merwe theory of crystal interfaces.
Self-sufficient and user-friendly, this book provides a complete introduction to the anisotropic elasticity theory necessary to model a wide range of crystal defects. Assuming little prior knowledge of the subject, the reader is first walked through the required basic mathematical techniques and methods. This is followed by treatments of point, line, planar and volume type defects such as vacancies, dislocations, grain boundaries, inhomogeneities and inclusions. Included are analyses of their elastic fields, interactions with imposed stresses and image stresses, and interactions with other defects, all employing the basic methods introduced earlier. This step by step approach, aided by numerous exercises with solutions provided, strengthens the reader's understanding of the principles involved, extending it well beyond the immediate scope of the book. As the first comprehensive review of anisotropic elasticity theory for crystal defects, this text is ideal for both graduate students and professional researchers.
Crystal structures and their associated electronic features play an enormous role in chemistry, constituting the most fundamental basis for analyzing and predicting properties of solid-state materials. In Crystal Structure: Properties, Characterization and Determination, the authors begin by discussing some of the refining models and X-ray data treatments for single-crystals containing heavy atoms, such as transition metals or lanthanides.Valuable information on crystal structures and microstructures may be obtained from the observation of high-resolution images if conditions associated iwth crystal thickness and defocus values are satisfied. These images include information not only on accurate atomic coordinates of cations but also on the ordered arrangements of oxygen atoms and oxygen vacancies.In the concluding study, measurements of the heat capacity of Y3-xErxAl5O12 (x=0,0.6,1.1,3), and mixed Er3-xTmx Al5O12, (x=0,1,2,3) and Er2HoAl5O12 solid solutions were carried out in the temperature range of 1.9 to 220 K in magnetic fields up to 9T. The findings suggest that heat capacity variations at low temperatures were impacted by Schottky anomalies. |
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