Structure determination by X-ray crystallography

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Structure determination by X-ray crystallography / M.F.C. Ladd and R.A. Palmer

版:

3rd ed

資料種別:

図書

出版情報:

New York : Plenum Press, c1993

形態:

xxiv, 586 p. ; 24 cm

著者名:

ISBN:

9780306442902 [0306442906]

書誌ID:

BA21009798

子書誌情報

フルテキスト

所蔵情報

他の版・巻

Structure determination by X-ray crystallography. 2nd ed (pbk.)
M.F.C. Ladd and R.A. Palmer , Plenum Press , c1985

書誌詳細

注記:

Includes bibliographical references and index

主題:

X-ray crystallography

言語:

英語

目次情報:

Physical Constants and Other Numerical Data

Notation

Crystal Morphology and Crystal Symmetry / Chapter 1：

Introduction / 1.1：

The Crystalline State / 1.2：

Stereographic Projection / 1.3：

External Symmetry of Crystals / 1.4：

Bibliography

Problems

Lattices and Space-Group Theory / Chapter 2：

Lattices / 2.1：

Families of Planes and Interplanar Spacings / 2.3：

Reciprocal Lattice-Geometrical Treatment / 2.4：

Unit-Cell Transformation / 2.5：

Rotational Symmetries of Lattices / 2.6：

Space Groups / 2.7：

Matrix Representation of Symmetry Operations / 2.8：

Diffraction Symbols / 2.9：

I X-rays, X-ray Diffraction, and Structure Factors II Intensities and Intensity Statistics / Chapter 3：

X-rays, X-ray Diffraction, and Structure Factors / I：

Generation and Properties of X-rays / 3.1：

X-ray Scattering / 3.2：

Scattering by Regular Arrays of Atoms / 3.3：

Reciprocal Lattice-Analytical Treatment / 3.4：

Scattering by a Crystal Structure / 3.5：

Using the Structure Factor Equation / 3.6：

Limiting Conditions and Systematic Absences / 3.7：

Practical Determination of Space Groups from Diffraction Data / 3.8：

Intensities and Intensity Statistics / II：

Intensity Expressions and Factors Affecting Intensities / 3.9：

Intensity Statistics / 3.10：

I Optical and X-ray Examination of Crystals II Measurement of Intensity Data from Single Crystals / Chapter 4：

Optical and X-ray Examination of Crystals

Polarized Light / 4.1：

Optical Classification of Crystals / 4.3：

Single-Crystal X-ray Techniques / 4.4：

Recognition of Crystal System / 4.5：

Measurement of Intensity Data from Single Crystals

Intensity Measurements on Photographs / 4.6：

Single-Crystal X-ray Diffractometry / 4.7：

Area Detectors (Position-Sensitive Detectors) / 4.8：

Monochromators / 4.9：

Focusing Mirrors / 4.10：

Twinning / 4.11：

Fourier Series and Fourier Transforms / Chapter 5：

Image Formation and Focusing / 5.1：

Fourier Series / 5.2：

Fourier Series in X-ray Crystallography / 5.3：

Holes and Atoms / 5.4：

Generalized Fourier Transform / 5.5：

Practice with Transforms / 5.6：

Some General Properties of Transforms / 5.7：

Convolution / 5.8：

Structure Solution in Brief / 5.9：

Fourier Techniques in X-ray Structure Determination / Chapter 6：

Analysis of the Unit-Cell Contents / 6.1：

Interpretation of Electron Density Distributions / 6.3：

Methods of Solving the Phase Problem / 6.4：

Anomalous Scattering / 6.5：

Neutron Diffraction / 6.6：

Direct Methods and Refinement / Chapter 7：

Direct Methods of Phase Determination / 7.1：

Patterson Search Methods / 7.3：

Least-Squares Refinement / 7.4：

Molecular Geometry / 7.5：

Precision / 7.6：

Correctness of a Structure Analysis / 7.7：

Limitations of X-ray Structure Analysis / 7.8：

Disorder in Single Crystals / 7.9：

Computer Prediction of Crystal Structures / 7.10：

Examples of Crystal Structure Determination / Chapter 8：

Crystal Structure of 2-Bromobenzo[b]indeno[1,2-e]pyran / 8.1：

Crystal Structure of Potassium 2-Hydroxy-3,4-dioxocyclobut-1-ene-1-olate Monohydrate KHSO / 8.3：

Structure Analysis by X-ray and Neutron Diffraction / 8.4：

Determination of an Intermediate Size Crystal Structure Using Direct Methods / 8.5：

Concluding Remarks / 8.6：

X-ray Structure Determination with Powders / Chapter 9：

Basis of the Powder Method / 9.1：

Data Collection / 9.3：

Indexing Powder Patterns / 9.4：

Extracting Integrated Intensities from a Powder Pattern / 9.5：

Rietveld Refinement / 9.6：

Examples of Solved Structures / 9.7：

Powder Diffraction with Proteins / 9.8：

Proteins and Macromolecular X-ray Analysis / 9.9：

Crystallization of Proteins and Complexes for X-ray Analysis / 10.1：

Crystal Mounting for X-ray Data Collection / 10.3：

Macromolecular Crystallography / 10.4：

Types of Fourier Synthesis for Protein Analysis / 10.5：

Determination of the Phases for Protein Crystals / 10.6：

Siras and MAD Phasing / 10.7：

Use of Phase Information and Density Modification / 10.8：

Macromolecular Structure Refinement and Solvent and Ligand Fitting / 10.9：

Structure Validation: Final Checks / 10.10：

Geometry Validation: Final Checks / 10.11：

Computer-Aided Crystallography / Chapter 11：

Derivation of Point Groups (EULR*) / 11.1：

Point-Group Recognition (SYMM*) / 11.3：

Structure Determination Simulation (XRAY*) / 11.4：

Crystal Structure Analysis Problems / 11.5：

General Crystal Structure and Other Programs / 11.6：

Automatic Powder Indexing (ITO12*) / 11.7：

Automatic Powder Structure Solving (ESPOIR*) / 11.8：

Appendices

Stereoviews and Crystal Models / A1：

Analytical Geometry of Direction Cosines / A2：

Schonflies' Symmetry Notation / A3：

Rotation Matrices / A4：

Spherical Trigonometry / A5：

Trigonometrical Formulae / A6：

Cartesian Coordinates / A7：

The integral [function of superscript infinity subscript 0 (sin x)/x] dx / A8：

Gamma Function / A9：

Crystallographic Software / A10：

Tutorial Solutions

Index / Solutions 1：

Physical Constants and Other Numerical Data

Notation

Crystal Morphology and Crystal Symmetry / Chapter 1：

Introduction / 1.1：

The Crystalline State / 1.2：

Stereographic Projection / 1.3：

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