Dispersion interaction of conjugated molecules: One- and many-electron models A. V. LuzanovV. V. Ivanov OriginalPaper Pages: 863 - 870
Magnetic properties and tunnel exchange states of dimeric mixed-valence clusters with two-electron transfer V. P. KoropchanuF. G. PaladiiV. Ya. Gamurar OriginalPaper Pages: 871 - 877
Embedded cluster calculation of the Ce3+ impurity in Lu2SiO5 crystals including crystal lattice relaxation and polarization A. Yu. KuznetsovA. B. SobolevO. A. Keda OriginalPaper Pages: 878 - 883
Exchange and magnetic dipole-dipole interactions in bi- and triradical complexes of Al(III), Ga(III), In(III), and Sn(IV) witho-semiquinones. PM3 calculation G. D. PerekhodtsevYa. S. Lebedev OriginalPaper Pages: 884 - 889
Ab initio investigation of the electronic structure of malonic dialdehyde derivatives I. B. LvovYu. V. IvanovV. I. Vovna OriginalPaper Pages: 890 - 894
Theoretical investigation of Wulf and Chappuis bands in the spectrum of ozone B. F. MinaevE. M. Kozlo OriginalPaper Pages: 895 - 900
Molecular structure and electronic effects of chlorophosphorane from mndo calculations and35Cl NQR data D. I. EfremovG. B. Soifer OriginalPaper Pages: 901 - 907
Synthesis and structure analysis of cyclic furfural acetals G. A. MelnitskayaA. Kh. KuramshinE. A. Kantor OriginalPaper Pages: 908 - 914
Molecular dynamic study of thermodynamic properties of water clusters containing sodium or chlorine ions A. E. GalashevF. SigonA. Servida OriginalPaper Pages: 915 - 924
Cellular nanostructure of gas hydrates B. Ya. SukharevskiiA. Yu. ProkhorovV. N. Vasyukov OriginalPaper Pages: 925 - 929
Rules for filling coordination spheres in cubic crystals with interstices M. D. StarostenkovS. V. DmitrievO. Kh. Starostenkova OriginalPaper Pages: 930 - 935
Calculation of optimal packing and comparison of intermolecular electrostatic interaction models in C60 crystals A. V. DzyabchenkoV. I. ShilnikovI. A. Suslov OriginalPaper Pages: 936 - 940
Occupation of trigonal vacancies and the spatial structure of superfullerides M. M. MestechkinG. E. Weiman OriginalPaper Pages: 941 - 946
Zefirov-Palyulin analysis of the form of the cyclohexanone fragment of 2-arylidene-and 2(O-aroyl)-oxymethylene-n-menthan-3-ones V. A. BacherikovYu. E. Shapiro OriginalPaper Pages: 947 - 953
Crystal and molecular structure of 6b,7,8,8a-tetramethyl-6b,8a-dihydrocyclobut[a]acenaphthylene and 1,2,2a,10b-tetramethyl-2a,10b-dihydrocyclobuta[l]phenanthrene T. V. RybalovaYu. V. GatilovV. G. Shubin OriginalPaper Pages: 954 - 958
Algorithm for variational calculations of molecular symmetry in solving anharmonic vibrational problems A. I. Pavlyuchko OriginalPaper Pages: 959 - 964
Extended molecular connectivity: Prediction of boiling points of alkanes A. A. ToropovA. P. ToropovaI. N. Ruban OriginalPaper Pages: 965 - 969
On the nature of the isomer shift in tin(IV) tetrachloride complexes with organic ligands from quantum chemical data V. A. VarnekA. A. Varnek Brief Communications Pages: 970 - 973
Benchmark full configuration interaction calculations of symmetric dissociation curves of ammonia and methane molecules A. L. Wulfov Brief Communications Pages: 974 - 977
Ab initio full configuration interaction program covariant-FCI for personal computers A. L. Wulfov Brief Communications Pages: 978 - 981
Ab initio full configuration interaction calculations of spectroscopic constants of N2, CO, CO+, BO, and BO+ molecules A. L. Wulfov Brief Communications Pages: 982 - 984
Crystal and molecular structure of 5,5-dimethyl-4,5-dihydro-7H-2-N-(3-ethoxy-1,2,4-triazolyl)-3-(1H-1,2,4-triazolyl)thieno[2,3-c]pyrane M. S. AleksanyanA. A. KarapetyanYu. T. Struchkov Brief Communications Pages: 985 - 988
Crystal and molecular structure of the 1:1 solvate of 6,6-dimethyl-4-oxo-2-N-(3-methyl-5-oxo-4H-pyrazolyl)-5,6-dihydro-8H-pyrano[4′,3′:4,5]thieno[2,3-d]pyrimidine with dimethylsulfoxide M. S. AleksanyanA. A. KarapetyanYu. T. Struchkov Brief Communications Pages: 989 - 992
Molecular structure refinement of 4-bromo(benzoyloxymethyl)-trifluorosilane é. A. ZelbstYu. é. OvchinnikovM. G. Voronkov Brief Communications Pages: 993 - 995