Electron Densities, Momentum Densities, and Density Matrices

Artikel in diesem Heft

1. Inhaltsverzeichnis
2. Proceedings of the Sagamore X Conference on Charge, Spin and Momentum Densities
3. Preface
4. Superposition and Polarization Effects on the Electron Density of Lone Pairs
5. X-Ray Diffraction Study of the Electron Density and Anharmonicity in K₂PtCl₆
6. The Identification of Phonon-Phonon Interactions in Anharmonic Crystals by X-Ray Diffraction Data
7. Electron Density and Anharmonic Thermal Atomic Vibrations in K_{1_ x}Li_xTaO₃ (x=0, 0.05, 0.15) Perovskites
8. Static and Dynamical Valence-Charge-Density Properties of GaAs
9. Electron Distribution in Some Zincblende-Type Crystals
10. Electron Density and Bonding in Ring Silicates: Beryl, Cordierite, Dioptase
11. Weak Reflections in the Laves Phase FeBe₂
12. Anomeric Effect and Charge Density of Dioxane and Dichlorodioxane
13. Electron Deformation Density at Temperatures around 20 K
14. Charge Density Study on Bullvalene (C₁₀H₁₀ )
15. Estimation of Charge Density on Nitrogen in Amides by Measurement of One-Bond Carbon-Hydrogen Nuclear Coupling Constants in N-CH₃ Group
16. New Opportunities for Charge Density Studies Using the FAST Area Detector
17. Entropy Maximizations on Electron Density
18. The Electron Density Distribution in Be Metal Obtained from Synchrotron-Radiation Powder Data by the Maximum-Entropy Method
19. Electrostatic Properties of Ions in Crystals from X-Ray Diffraction Data
20. Electrostatic Properties of Molecules from the X-Ray Charge Density. Application to Deuterated Benzene, 1-Alanine and d,l-Histidine
21. Electrostatic Potential from High-Resolution X-Ray Diffraction. Application to a Pseudo-Peptide Molecule
22. Preliminary Results of a 20 K X-Ray Study of Citrinin
23. Electrostatic Properties of 3-(p-Ethoxyphenyl) sydnone
24. Ab initio Study of the Spin Density of Nitroxide Radicals
25. Experimental and Theoretical Spin Densities in Two Alkyl Nitroxides
26. Spin Densities in Copper-Nitronyl Nitroxide Complexes
27. Spin Transfer through Hydrogen Bonding in [CO(NH₃)₅(OH₂)][Cr(CN)₆] ?
28. Nonnuclear Maxima in the Charge Density
29. Electron Charge and Current Densities, the Geometrie Phase and Cellular Automata
30. Visualization of Shapes of Molecular Anions
31. Use of Symmetry in Coupled Hartree-Fock Calculations of Non-linear Response Tensors in Molecules
32. On the Topography of Electron Momentum Densities of Linear Molecules
33. Momentum Distribution and Charge Density in Solid-State Theory
34. A Comparison between Polyatecylene and Polycarbonitrile
35. Modern Band Theory of Disordered Alloys: Basic Concepts Including a Discussion of Momentum Densities
36. Electron Density Distributions and Atomic Charges
37. Core-Orthogonalization Effect in Pseudopotential Theory of the Charge Density Distribution of Valence Electrons in Semiconductors with Comments on the Effects in Momentum Space
38. Calculation of Compton Profiles Using a Multipole Expansion of the Momentum Density
39. Electron Densities, Momentum Densities, and Density Matrices
40. On the Inference of the One-Particle Density Matrix from Position and Momentum-Space Form Factors
41. Atomic Orbitals from Compton Profiles
42. Nondiagonal Response of Electrons by Coherent Inelastic X-Ray Scattering
43. Dynamic Structure Factor: An Introduction
44. The Generalised Oscillator-Strength Density of the Helium Atom, Calculated by a New Implementation of the Complex-Coordinate Method
45. Double-Ionisation Processes and Electronic Structures
46. The Effect of Correlation on the Double Ionization of Helium by Fast Electrons
47. Compton Profiles for Atoms and Molecules: Compton Defects
48. Theories of Compton Scattering by Magnetic Materials
49. Recent Advances in Compton Scattering
50. Electron Momentum Densities by (y, e y)-Spectroscopy
51. Performance of the Compton Spectrometer at HARWI/HASYLAB
52. The Dynamic Structure Factor of LiC₆ and KC₈ : Inelastic Synchrotron X-Ray Scattering Results
53. Ultrahigh-Energy-Resolution Inelastic X-Ray Scattering Spectroscopy
54. Anisotropy of the Electron Momentum Distribution in Pyrolytic Graphite Studied Using a WK_a1 Spectrometer
55. The Asymmetry of the Compton Profiles and its Dependence on the Geometrical Resolution
56. The Anisotropy of the Reciprocal Form Factor and the Electronic Structure of Crystalline Lithium Hydride
57. Compton Profile of Boron Nitride
58. The Electronic Structure of Hydrogen Bonding in a-Oxalic Acid Dihydrate
59. Momentum-Density Studies of Some Compounds with Triatomic Linear Anions
60. Compton Scattering from Heavier Metals
61. The Electron Momentum Distribution in Lead
62. Bremsstrahlung Contribution in Compton Scattering from Heavy Metals
63. Compton Scattering Experiments with Polychromatic Radiation
64. (e, 2 e)-Spectroscopy and the Electronic Structure of Molecules. A Short Review with Selected Examples
65. Recent Advances in Electron Momentum Spectroscopy
66. What Can Positrons Contribute to High-T_c Superconductivity?
67. Positron Annihilation Studies of the Electronic Structure and Fermiology of High-T_c Superconductors
68. High-Resolution Neutron Spectroscopy for the Investigation of Hydrogen Diffusion and Molecular Rotations in Solids
69. Single-Particle Momentum Distributions from Deep Inelastic Neutron Scattering (DINS)
70. Deep Inelastic Neutron Scattering in the Study of Atomic Momentum Distributions
71. Neutron and PIMC Determination of the Longitudinal Momentum Distribution of HCP, BCC and Normal Liquid 4 Het
72. Deep Inelastic Neutron Scattering Studies of Atomic Momentum Distributions in Condensed Argon and Neon
73. Investigations of the Anisotropic Optical Reflectivity of Binary and Ternary Nb-W Oxides Possessing Block-Type Crystal Structure