Contents
Crystallography Reports

Vol. 49, No. 5, 2004

Simultaneous English language translation of the journal is available from MAIK “Nauka / Interperiodica” (Russia).
Distributed worldwide by the American Institute of Physics. Crystallography Reports ISSN 1063-7745.

Theory of Crystal Structures

Radii of Ions and Frequency of Their Occurrence

N. L. Smirnova p. 705  abstract

Computer Simulation of the Structure of Small Tungsten Oxide Clusters

E. A. Nikitina, M. E. Prokhorski, L. V. Tunichenko, and A. D. Fofanov p. 713  abstract

Crystal Chemistry

Problems in Crystal Chemistry of Ferroelectric and Antiferroelectric Perovskites

V. A. Isupov p. 719  abstract

Structure of Inorganic Compounds

Phosphates of Pentavalent Elements: Structure and Properties

A. I. Orlova and A. K. Koryttseva p. 724  abstract

Unstrained Bond Lengths and Corresponding Cation Radii in Crystals with Perovskite Structure

N. M. Olekhnovich p. 733  abstract

Crystal Structures of Double Cesium Zirconium and Barium Zirconium Orthophosphates

E. R. Gobechiya, Yu. K. Kabalov, V. I. Pet’kov, and M. V. Sukhanov p. 741  abstract

Synthesis and Crystal Structure of Rare Earth Selenates Nd(HSeO₄)₃, Sm(HSeO₄)₃, and Nd₂(SeO₄)₃ · 5H₂O

M. A. Zakharov, S. I. Troyanov, and E. Kemnitz p. 747  abstract

Structure of Organic Compounds

Clathrates of Dianilinegossypol with Lower Acetate Ester Homologues: Structure, Isomorphism,
and Morphotropic Transitions

S. A. Talipov , B. T. Ibragimov , K. M. Beketov^,, K. D. Praliev , and T. F. Aripov p. 752  abstract

Physicochemical Properties of Solutions of Bis(2,3,5,6-Tetraoxo-4-Nitropyridinate) Dianions.
Crystal Structures of Sodium 2,3,5,6-Tetraoxo-4-Nitropyridinate Trihydrate and Sodium Ammonium
Bis(2,3,5,6-Tetraoxo-4-Nitropyridinate) Monohydrate

N. E. Kuz’mina, O. V. Koval’chukova, S. B. Strashnova, K. K. Palkina,
B. E. Zatsev, and N. Yu. Isaeva p. 758  abstract

Structure of the Undecahydrodecaborate Anion B₁₀. Crystal Structures of [Ph₃PCH₂Naph]B₁₀H₁₁
and [Ph₃PEt]₂B₁₀H₁₀

I. N. Polyakova, V. N. Mustyatsa, K. Yu. Zhizhin, and N. T. Kuznetsov p. 767  abstract

Molecular and Crystal Structure of Diperoxides: X-ray Diffraction Studies of 2,5-Dimethyl-2,5-
Dihydroperoxyhexane, 2,5-Dimethyl-2,5-Dihydroperoxyhex-3-ine, 2,5-Dimethyl-2,5-
Di(tert-butylperoxy)hexane, and 1,4-Bis[2-(2-tert-butylperoxy)propyl]benzene

V. N. Khrustalev, M. Yu. Antipin, A. Yu. Kosnikov, and V. L. Antonovski^† p. 772  abstract

Molecular Structure of [(C₅H₅)₂(C₅H₄CH₃)(C₄H₈O)Sm]

Taiqi Liu, Fuchen Ding , Jingli Li, and Qi Shen p. 779  abstract

Crystal Structure of the Mixed-Ligand Copper(II) Complex with S-Proline-N-Monoacetate
Dianion and Imidazole [Cu(Proma)(Im)] · H₂O

A. S. Antsyshkina, G. G. Sadikov, V. S. Sergienko, and A. L. Poznyak p. 783  abstract

Synthesis and the Crystal and Molecular Structures of a Germanium(IV)–Copper(II) Heteronuclear
Diethylenetriaminepentaacetate Complex, [Cu(µ-HDtpa)₂{Ge(OH)}₂] · 12H₂O

V. S. Sergienko, G. G. Aleksandrov, I. I. Sefullina, and E. É. Martsinko p. 788  abstract

Crystal Structure and Spectral Characteristics of 2-Methyl-3-Chloro-9-Hydroxypyrido[1,2-a]pyrimidin-4-one
and Bis(2-Methyl-3-Chloro-9-Hydroxypyrido[1,2-a]pyrimidin-4-onium) Perchlorate

O. V. Koval’chukova, N. I. Mordovina, N. E. Kuz’mina, S. V. Nikitin,
B. E. Zatsev, S. B. Strashnova, and K. K. Palkina p. 792  abstract

Conformational Polymorphism of N-(4-Butoxyphenyl)-4-(4'-Nitrophenyl)-2-Thiazolamine

L. N. Kuleshova, B. B. Averkiev, D. V. Gusev, K. Yu. Suponitski, and M. Yu. Antipin p. 798  abstract

Crystal and Molecular Structure of [Co(DH)(o-phen)₂][BF₄]₂ · 2H₂O

S. T. Malinovski, O. A. Bologa, É. B. Coropceanu, and N. V. Gerbeleu p. 807  abstract

Real Structure of Crystals

Microtip Roughness of Erosion-Induced Disturbed Layers in Silicon Carbide Crystals

V. A. Karachinov p. 811  abstract

Mechanism of Spatial Ordering of Dislocations during Plastic Deformation of Crystals

G. F. Sarafanov p. 816  abstract

Crystallographic Shear in Niobium Oxides of Different Compositions

L. A. Reznichenko, L. A. Shilkina, E. S. Gagarina, Yu. I. Yuzyuk, O. N. Razumovskaya, and A. V. Kozinkin p. 820  abstract

Lattice Dynamics and Phase Transitions

Comparative Analysis of Two Methods of Calculation of the Orientation of Domain Walls in Ferroelastics

V. A. Nepochatenko p. 828  abstract

Transitions to the Relaxor and Dipole-Glass States in Mixed Crystals of the Potassium
Dihydrogen Phosphate Family

L. N. Korotkov and L. A. Shuvalov p. 832  abstract

Physical Properties of Crystals

Theoretical Calculation of Optical Properties of Crystals with Statistical Distribution of Atoms
over Crystallographic Positions Based on the Model of Point Dipoles

D. Yu. Popov and O. A. Popova p. 843  abstract

Electrons of l Shells of Free Atoms As a Regular System of Points on a Sphere: I. Modeling by Polyhedra

T. F. Veremechik and R. V. Galiulin p. 847  abstract

Surface, Thin Films

Growth and Real Structure of Diamond Films Synthesized on Polycrystalline Tungsten Substrates

V. D. Aleksandrov and I. V. Sel’skaya p. 851  abstract

Crystal Growth

Flux Crystallization of Trigonal GdFe₃(BO₃)₄ Competing with the Crystallization of -Fe₂O₃

L. N. Bezmaternykh, S. A. Kharlamova, and V. L. Temerov p. 855  abstract

Initial Stages of Nucleation of Carbide Phases in Oxide Melts

V. V. Malyshev and A. I. Gab p. 858  abstract

Crystallographic Software

Algorithms for Solving Atomic Structures of Nanodimensional Clusters in Single Crystals Based
on X-ray and Neutron Diffuse Scattering Data

N. M. Andrushevski, B. M. Shchedrin, and V. I. Simonov p. 863  abstract

A Program Set for Direct Calculation of Vibrational States of Crystal Structures in a Molecular Approach

L. A. Gribov and V. A. Dement’ev p. 871  abstract

Jubilees

Evgeni Invievich Givargizov (on the Occasion of His 70th Birthday) p. 878

DmitriYur’evich Pushcharovski(on the Occasion of His 60th Birthday) p. 880

Memorial Data

On the Occasion of the 100th Birthday of Nikola Alekseevich Brilliantov p. 882

Obituaries

Oleg Pavlovich Aleshko-Ozhevsky (July 3, 1934–January 25, 2004) p. 884

Errata

“Indicators of the Magnetic State in the Charge Distributions of MnO, CoO, and NiO.
II: Para- and Antiferromagnetism of CoO” [Crystallogr. Rep. 49, 357 (2004)]

J.-P. Vidal, G. Vidal-Valat, and K. Kurki-Suonio p. 886

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