Interatomic interactions and electronic structure of NbSe2 and Nb1.25Se2 nanotubes A. N. EnyashinV. V. IvanovskayaA. L. Ivanovskii OriginalPaper Pages: 547 - 556
Electronic effects of substituents on the conformational characteristics of the 1,2-dihydropyridine ring O. V. ShishkinR. I. Zubatyuk OriginalPaper Pages: 557 - 562
Ab initio study of aniline and n-propylamine associates with nitrobenzene and m-cresol I. A. NovakovV. V. KorolkovL. A. Gribov OriginalPaper Pages: 563 - 569
DFT ab initio study of the keto-enol tautomerism of barbituric acid V. B. Delchev OriginalPaper Pages: 570 - 578
Ab initio structural study of M(mda)2 complexes (M = Be, Mg, Ca; mda = C3O2H3) V. V. SliznevS. B. LapshinaG. V. Girichev OriginalPaper Pages: 579 - 590
Vibrational spectra of 2-biphenylmethanol. Spectrum simulation and molecular structure L. M. BabkovJ. BaranS. V. Trukhachev OriginalPaper Pages: 591 - 598
Quantum-chemical study of CnF2 n+2 conformers. Structure and IR spectra L. N. IgnatievaA. Yu. BeloliptsevV. M. Buznik OriginalPaper Pages: 599 - 609
Quantum-chemical study of potassium and ammonium hexafluorozirconates E. I. VoitA. V. VoitV. I. Sergienko OriginalPaper Pages: 610 - 616
Quantum-chemical modeling of photoelectron spectra and electronic structure of tris-β-diketonates of 3d-metals Sc, Ti, V V. I. VovnaI. S. Osmushko OriginalPaper Pages: 617 - 625
Fragment descriptors in QSPR: Application to magnetic susceptibility calculations N. I. ZhokhovaI. I. BaskinN. S. Zefirov OriginalPaper Pages: 626 - 635
The role of neutral defects in the structural chemistry of liquid water G. A. DomrachevD. A. SelivanovskiiV. L. Vaks OriginalPaper Pages: 636 - 642
Hydrogen bonding contribution to the water pair interaction potential: Effects on the model liquid structure A. V. BorovkovM. L. AntipovaYu. M. Kessler OriginalPaper Pages: 643 - 647
Reverse Monte Carlo and Voronoi-Delaunay simulation and structure analysis for liquid metals A. S. RoikV. P. KazimirovV. E. Sokolskii OriginalPaper Pages: 648 - 656
Phase formation in the Dy2O3-HfO2-MoO3 system. Crystal structure of the new binary molybdate Dy2Hf2(MoO4)7 S. F. SolodovnikovB. G. BazarovZh. G. Bazarova OriginalPaper Pages: 657 - 662
Synthesis and structure of isomeric (μ-H)Os3(μ,η2-(O,N)-6,6-clusters of dimethyl-2-methylene-bicyclo[3.1.1]heptan-3-one oxime)(CO)10. Crystal structure of one of the isomers V. A. MaksakovN. V. PervukhinaA. V. Tkachev OriginalPaper Pages: 663 - 670
Crystal and molecular structure of copper(II) trans-bis-(2-(methylimino)-4-pentanonate) I. A. BaidinaP. A. StabnikovI. K. Igumenov OriginalPaper Pages: 671 - 677
X-ray study of volatile Ni(II), Cu(II), and Pd(II) complexes of β-ketoimine pivalyltrifluoroacetone I. A. BaidinaG. I. ZharkovaI. K. Igumenov OriginalPaper Pages: 678 - 687
Crystal structure and characterization of the bis(n-benzyl-benzotriazole-n3)-dichloro Co(II) complex: CoCl2(C6H4N3CH2Ph)2 F. JianH. WangH. Xiao OriginalPaper Pages: 688 - 693
Magnetochemistry of boron hydride structures. Empirical aspects V. V. VolkovV. N. Ikorskii OriginalPaper Pages: 694 - 705
QSPR modeling of vitrification temperatures for polyarylene oxides A. A. ToropovI. N. NurgalievS. Sh. Rashidova Brief Communications Pages: 706 - 712
Some structural peculiarities of formamide-water binary mixtures according to proton spin-spin relaxation data I. V. SukhnoV. Yu. BuzkoI. A. Kovaleva OriginalPaper Pages: 713 - 715
Some structural peculiarities of CH3COOH-H2O binary mixtures according to proton spin-spin relaxation data V. Yu. BuzkoI. V. SukhnoT. E. Dzhioev OriginalPaper Pages: 716 - 719
Crystal structure of the synthetic analog of radtkeite Hg3S2Cl1.00I1.00 N. V. PervukhinaS. V. BorisovB. G. Nenashev OriginalPaper Pages: 720 - 723
Crystal structure of 1-(2-pyridiniomethyl)-2,4-bis(phenylsulfonyl)benzene bromide A. N. Chekhlov OriginalPaper Pages: 724 - 728