Theoretical investigation of the structure and stability of salt molecules LiOF, LiOCl, LiSF, LiSCl and ion-molecular complexes Li+·F2, Li+·FCl, and Li+·Cl2 D. G. MusaevO. P. Charkin OriginalPaper Pages: 1 - 7
Theoretical study of the structure and stability of dimers (LiBO)2, (LiAlO)2, (LiBS)2, and (LiAlS)2 D. G. MusaevV. V. YakobsonO. P. Charkin OriginalPaper Pages: 7 - 13
Geometry of OH− defect in condensed water phase. defect localization and cooperative interaction of H-bonds A. N. IsaevA. A. Levin OriginalPaper Pages: 14 - 19
MNDO/HB study of proton transfer in the condensed phase of H2O including medium effects in the combined “supermolecule and pseudocontinuum” model A. N. IsaevA. A. Levin OriginalPaper Pages: 19 - 25
Theoretical analysis of ring form in 1,3,2-dithioand 1,3,2-oxathioborinanes V. A. BacherikovA. I. Gren'V. Ya. Gorbatyuk OriginalPaper Pages: 25 - 28
Geometric structure of molecule of 1,3-dinitro-1,3-diazacyclopentane in the gas phase I. F. ShishkovT. L. El'fimovaV. P. Ivshin OriginalPaper Pages: 29 - 33
Geometric structure of molecule of 1,3,5-trinitro-1,3,5-triazacyclohexane in the gas phase I. F. ShishkovT. L. El'fimovaL. V. Vilkov OriginalPaper Pages: 34 - 38
Geometric structure of molecule of N-nitropyrrolidine in the gas phase I. F. ShishkovL. V. VilkovN. F. Pyatakov OriginalPaper Pages: 38 - 42
Topological simulation of13C NMR spectra of polyoxy derivatives of benzene V. I. DostovalovaL. A. Fedorov OriginalPaper Pages: 43 - 51
Photoelectron spectra of trialkylphosphine oxides V. I. VovnaB. V. OkhotaYu. V. Prikhod'ko OriginalPaper Pages: 52 - 57
Features of Cu−S chemical bond in BaCu2S2 M. S. OsadchiiÉ. A. KravtsovaYu. P. Dikov OriginalPaper Pages: 58 - 61
Neutron studies of self-diffusion of water molecules in electrolyte solutions V. T. KrotenkoA. K. DoroshA. A. Vasil'kevich OriginalPaper Pages: 61 - 67
Structure of two polymeric complexes of Co(II) and Cu(II) with a spin-labeled enaminoketone of 3-imidazolidine G. V. RomanenkoN. V. Podberezskaya OriginalPaper Pages: 80 - 85
X-ray diffraction study of Ni(II) complexes with the macrocyclic ligand 1,3,6,9,11,14-hexaazatricyclo-[12,2,1,16,9]-octadecane G. V. RomanenkoN. V. Podberezskaya OriginalPaper Pages: 86 - 90
Crystal and molecular structures of volatile complexes formed by bis(diethyldithiocarbamato)cadmium with 1,10-phenanthroline and 2,2′-dipyridyl L. A. GlinskayaR. F. KlevtsovaS. M. Zemskova OriginalPaper Pages: 91 - 97
Crystal and molecular structure of complex cis-[(VAL)2Pd]·H20 V. Z. PletnevYu. A. ZolotarevA. I. Verenich OriginalPaper Pages: 98 - 102
Crystal structure of Cu(I) π-complexes from the system CuBr−HBr-diallylamine V. V. OliinikM. G. Mys'kivPak Sek Bon OriginalPaper Pages: 103 - 107
Crystal and molecular structure of C6H5SnCl3(HMPA)2 (HMPA=Hexamethylphosphoric triamide) A. V. YatsenkoS. V. MedvedevL. A. Aslanov OriginalPaper Pages: 107 - 112
Crystal and molecular structure of hepta(diphenylsulfoxide)calcium bis(phenylpentachloroantimonate) [Ca(diphenylsulfoxide)7]2+− [PhSbCl5]2 − A. V. YatsenkoE. G. ZaitsevaL. A. Aslanov OriginalPaper Pages: 112 - 117
Conformational structure of pyrylo-2-monomethinecyanine and its thio analogs S. V. SeredaA. A. IshchenkoA. I. Tolmachev OriginalPaper Pages: 117 - 122
Molecular structure of a series of epoxysulfolanes and products of their reaction with sodium azide L. I. KurshevaO. N. KataévaV. A. Naumov OriginalPaper Pages: 123 - 127
Parametrization of the semiempirical MINDO/3 quantumchemical method for zinc-containing compounds N. U. ZhanpeisovG. M. Zhidomirov Brief Communications Pages: 128 - 130
Compact formula for Coulomb integrals of Slater orbitals A. F. Shestakov Brief Communications Pages: 131 - 133
Theoretical investigation of the stability, equilibrium geometry, and electronic structure of the (CH3)2SiH+ and+CH2CH3SiH2 cations B. F. ShchegolevT. A. Kochina Brief Communications Pages: 134 - 137
Nonempirical calculation of the potential energy surface for the O 2 − −H2O system V. V. SmolinskiiS. A. Shchekatolina Brief Communications Pages: 138 - 141
Quantum mechanical investigation of interionic and ion-molecule interactions in AsF6 −...Li+ and AsF6 −...NCCH3 complexes I. S. PerelyginS. A. ShatokhinA. B. Kononenko Brief Communications Pages: 142 - 144
Simplified version for the numerical determination of potential constants V. P. MorozovV. E. Sorochinskaya Brief Communications Pages: 145 - 146
Relationship of orientational order parameters of impurity molecules in a nematic matrix E. M. Aver'yanovV. M. MuratovV. G. Rumyantsev Brief Communications Pages: 147 - 150
ESR spectra of oxygen radical-ions in kaolinite G. V. KharlamovI. A. Ivan'kinV. F. Anufrienko Brief Communications Pages: 151 - 153
Ellipsometry — A precision method for studying physicochemical surface phenomena S. V. Rykhlitskii Brief Communications Pages: 154 - 155