Works matching IS 00224766 AND DT 2003 AND VI 44 AND IP 3

Results: 24

Modeling Active Centers in Ammonia Synthesis. DFT Study of Dissociative Adsorption of N<sub>2</sub> on Ru Clusters.

Published in:

Journal of Structural Chemistry, 2003, v. 44, n. 3, p. 341, doi. 10.1023/B:JORY.0000009659.26326.cd

By:

Ruzankin, S. F.;
Avdeev, V. I.;
Dobrynkin, N. M.;
Zhidomirov, G. M.;
Noskov, A. S.

Publication type:

Article

Application of the Modified Exchange Correlation Potential to the Scattered Wave Cluster Method: Some Problems.

Published in:

Journal of Structural Chemistry, 2003, v. 44, n. 3, p. 351, doi. 10.1023/B:JORY.0000009660.39061.69

By:

Korol, Yu. L.;
Sobolev, A. B.;
Kuznetsov, A. Yu.

Publication type:

Article

Additive Schemes for Calculating the Properties of Alkane Conformers Including Interdependent Bond Rotation. I. Enthalpy.

Published in:

Journal of Structural Chemistry, 2003, v. 44, n. 3, p. 357, doi. 10.1023/B:JORY.0000009661.06300.71

By:

Sokolov, D. V.;
Nilov, D. Yu.;
Smolyakov, V. M.

Publication type:

Article

Structure of the Paramagnetic Products of Thiocyanate Photolysis at 77 K.

Published in:

Journal of Structural Chemistry, 2003, v. 44, n. 3, p. 404, doi. 10.1023/B:JORY.0000009667.51492.c8

By:

Eremin, L. P.;
Poleshchuk, O. Kh.;
Poluboyarov, V. A.;
Babovskaya, L. V.;
Lapin, A. E.

Publication type:

Article

Structure of the Ligand and Solvation Shells of the Giant <MATH>{\rm Pd}_561 {\rm Phen}_60 {\rm (OAc)}_180</MATH> Cluster.

Published in:

Journal of Structural Chemistry, 2003, v. 44, n. 3, p. 376, doi. 10.1023/B:JORY.0000009663.28896.35

By:

Stoyanov, E. S.;
Chesalov, Yu. A.;
Kochubei, D. I.;
Stolyarov, I. P.;
Vargaftik, M. N.

Publication type:

Article

Vibrational Spectroscopy Study of Fluorozirconate Glasses Containing Tin Difluoride and Gallium Trifluoride.

Published in:

Journal of Structural Chemistry, 2003, v. 44, n. 3, p. 381, doi. 10.1023/B:JORY.0000009664.30201.33

By:

Ignatieva, L. N.;
Stremousova, E. A.;
Merkulov, E. B.

Publication type:

Article

Geometry Optimization and Quantum-Chemical Calculations of Normal Vibrations for Methyl-N-methylurethane and Methyl-N-(<MATH>\alpha</MATH>)Naphthylurethane.

Published in:

Journal of Structural Chemistry, 2003, v. 44, n. 3, p. 388, doi. 10.1023/B:JORY.0000009665.33772.65

By:

Zavodov, I. A.;
Zverev, V. V.;
Maklakov, L. I.

Publication type:

Article

Temperature Dependence of NMR Relaxation Rate in Some Aqueous Electrolytes of Semimolar Concentration.

Published in:

Journal of Structural Chemistry, 2003, v. 44, n. 3, p. 397, doi. 10.1023/B:JORY.0000009666.65571.26

By:

Melnichenko, N. A.;
Bazhanov, A. V.;
Kupriyanov, A. S.

Publication type:

Article

Complexation of Carbamoylphosphine Oxide with Nitric and Perchloric Acids in Water<MATH>-</MATH>Dichloroethane Equilibrium Solutions.

Published in:

Journal of Structural Chemistry, 2003, v. 44, n. 3, p. 365, doi. 10.1023/B:JORY.0000009662.06643.3b

By:

Stoyanov, E. S.;
Vorob'yova, T. P.;
Smirnov, I. V.

Publication type:

Article

Chemical Bond Effects on Line Intensities in Arsenic X-Ray Emission Spectrum.

Published in:

Journal of Structural Chemistry, 2003, v. 44, n. 3, p. 410, doi. 10.1023/B:JORY.0000009668.66258.12

By:

Kupriyanova, T. A.;
Filippov, M. N.;
Lyamina, O. I.

Publication type:

Article

Nanostructural Approach to Proton Ordering in Gas Hydrate Cages.

Published in:

Journal of Structural Chemistry, 2003, v. 44, n. 3, p. 420, doi. 10.1023/B:JORY.0000009669.81917.29

By:

Kirov, M. V.

Publication type:

Article

Topological Limitations for Spheroidal Nanostructures of Gas Hydrate Cages.

Published in:

Journal of Structural Chemistry, 2003, v. 44, n. 3, p. 429, doi. 10.1023/B:JORY.0000009670.96477.df

By:

Kirov, M. V.

Publication type:

Article

X-Ray Investigation of Tungsten Carbides Synthesized by Cumulative Explosion.

Published in:

Journal of Structural Chemistry, 2003, v. 44, n. 3, p. 434, doi. 10.1023/B:JORY.0000009671.41739.f5

By:

Gromilov, S. A.;
Kinelovskii, S. A.

Publication type:

Article

<MATH>[{\rm Hg}_3]^{4+}</MATH> Cation in Inorganic Crystal Structures.

Published in:

Journal of Structural Chemistry, 2003, v. 44, n. 3, p. 441

By:

Borisov, S. V.;
Magarill, S. A.;
Pervukhina, N. V.

Publication type:

Article

Structure of Two Crystal Modifications of Cu(II) <MATH>trans</MATH>-Bis-(1,1,1-trifluoro-4-iminopentan-2-onate).

Published in:

Journal of Structural Chemistry, 2003, v. 44, n. 3, p. 448, doi. 10.1023/B:JORY.0000009673.81918.bd

By:

Baidina, I. A.;
Gromilov, S. A.;
Zharkova, G. I.;
Stabnikov, P. A.

Publication type:

Article

Crystal Structure Refinement for 3,5-Dimethyl-1,7-diphenyl-4-(2,4,6-trinitrophenyl)-2,6-diazahepta-2,4-diene and Crystal Structure Determination for Its Hydrochloride.

Published in:

Journal of Structural Chemistry, 2003, v. 44, n. 3, p. 457, doi. 10.1023/B:JORY.0000009674.83223.b4

By:

Chekhlov, A. N.

Publication type:

Article

X-Ray Photoelectron Diffraction. Possibilities of Surface Structural Analysis.

Published in:

Journal of Structural Chemistry, 2003, v. 44, n. 3, p. 465, doi. 10.1023/B:JORY.0000009675.42838.de

By:

Shalaeva, E. V.;
Kuznetsov, M. V.

Publication type:

Article

Sublattice Method in Chemical Bond Theory for Dolomite Crystals.

Published in:

Journal of Structural Chemistry, 2003, v. 44, n. 3, p. 499, doi. 10.1023/B:JORY.0000009676.74638.61

By:

Zhuravlev, Yu. N.;
Poplavnoi, A. S.

Publication type:

Article

Molecular Conformation of <MATH>2,2'</MATH>-Dinitrodiphenylamine According to Dielectric Studies and Ab Initio Quantum Chemical Calculations.

Published in:

Journal of Structural Chemistry, 2003, v. 44, n. 3, p. 502, doi. 10.1023/B:JORY.0000009677.82536.1f

By:

Krivoruchka, I. G.;
Vokin, A. I.;
Turchaninov, V. K.

Publication type:

Article

Crystal Structure of <MATH>{\rm HAsUO}_6\cdot 4{\rm H_2O}</MATH>.

Published in:

Journal of Structural Chemistry, 2003, v. 44, n. 3, p. 506, doi. 10.1023/B:JORY.0000009678.20174.e6

By:

Alekseev, E. V.;
Nosov, S. S.;
Suleimanov, E. V.;
Chernorukov, N. G.;
Chuprunov, E. V.

Publication type:

Article

Crystal Structure of di-(L-alanine)Monophosphite Monohydrate <MATH>[{\rm C}_3{\rm O}_2{\rm NH}_7 ]_2 \cdot {\rm H}_3 {\rm PO}_3 \cdot {\rm H}_2{\rm O}</MATH>.

Published in:

Journal of Structural Chemistry, 2003, v. 44, n. 3, p. 511, doi. 10.1023/B:JORY.0000009679.79788.74

By:

Smolin, Yu. I.;
Lapshin, A. E.;
Pankova, G. A.

Publication type:

Article

Crystal and Molecular Structure of 4-Nitro-2-oximino-3-phenylamino-3-thiolene-1,1-dioxide.

Published in:

Journal of Structural Chemistry, 2003, v. 44, n. 3, p. 516, doi. 10.1023/B:JORY.0000009680.28621.7d

By:

Chekhlov, A. N.

Publication type:

Article

Crystal and Molecular Structure of 1-(<MATH>p</MATH>-Tolyl)-4-[4-(<MATH>N</MATH>-naphthalimido)butyl]piperazine.

Published in:

Journal of Structural Chemistry, 2003, v. 44, n. 3, p. 521, doi. 10.1023/B:JORY.0000009681.65159.ed

By:

Simonov, Yu. A.;
Chumakov, Yu. M.;
Soboleva, S. G.;
Andronati, S. A.;
Bocelli, G.;
Voronina, T. A.

Publication type:

Article

Molecular and Crystal Structure of S-(5,6-dinitro-2-benzimidazolyl)methylthiuronium Chloride.

Published in:

Journal of Structural Chemistry, 2003, v. 44, n. 3, p. 526, doi. 10.1023/B:JORY.0000009682.80819.4d

By:

Kambulov, Yu. E.;
Usova, E. B.;
Zavodnik, V. E.;
Krapivin, G. D.

Publication type:

Article