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Title
Authors
Vol 60, No 10 (2019)
Pseudorotation of the Benzene Radical Cation Associated with HCN or CH3CN Molecules
Beregovaya I.V., Andreev R.V., Shchegoleva L.N.
PDF
(Eng)
Vol 59, No 3 (2018)
Numerical Calculation of Permittivity and Dielectric Loss of Aqueous KF Solution Depending on State Parameters
Odinaev S., Makhmadbegov R.S.
PDF
(Eng)
Vol 58, No 3 (2017)
A quantum chemical study of gallium(III) (μ-oxo)bis[phthalocyaninate] and gallium(III) (μ-oxo)bis[perfluorophthalocyaninate] molecules
Semenov S.G., Bedrina M.E.
PDF
(Eng)
Vol 60, No 9 (2019)
Frequency Dispersion of the Electroelasticity Modulus in Aqueous Electrolyte Solutions
Odinaev S., Akdodov D.M., Idibegzoda K.I.
PDF
(Eng)
Vol 59, No 3 (2018)
Structural and Chemical Characteristics of Model Molecular Fragments of Petroleum Resins
Shutkova S.A., Dolomatov M.Y., Dolomatova M.M., Petrov A.M., Kharudinov I.R.
PDF
(Eng)
Vol 58, No 3 (2017)
Induction of radiative forbidden transitions in an oxygen molecule in O2–H2O collision complexes
Shchepin A.S., Peshkova T.V., Peshkov S.A.
PDF
(Eng)
Vol 60, No 3 (2019)
Frequency Dispersion of the Specific Conductance Coefficient in Aqueous Electrolyte Solutions
Odinaev S., Akdodov D.M., Idibegzoda K.I.
PDF
(Eng)
Vol 59, No 3 (2018)
First-Principles Study of the Structures and Electronic Properties of Nin–1Al (n = 2-20) Clusters
Song W., Wang B., Li H., Wang J., He C.-.
PDF
(Eng)
Vol 58, No 2 (2017)
Analysis of aliphatic α,ω-diols: Crystal structures, application and progress of A. I. Kitaigorodsky ideas
Grineva O.V.
PDF
(Eng)
Vol 60, No 3 (2019)
Perfluorobenzocyclobutene Radical Anion: A Structurally Flexible Particle
Beregovaya I.V., Shchegoleva L.N., Borovkov V.I., Karpov V.M.
PDF
(Eng)
Vol 59, No 3 (2018)
Problem of Molecular Vibrations with the Gaussian Potential
Gribov L.A.
PDF
(Eng)
Vol 58, No 1 (2017)
Electronic structure with a dipole moment calculation of the low-lying electronic states of the KHe molecule
Kontar S., Korek M.
PDF
(Eng)
Vol 60, No 2 (2019)
Conformational Stabilities, Rotational Barriers, and Vibrational Spectra of 2-Pyrrolecarboxaldehyde and 3-Pyrrolecarboxaldehyde Calculated Using Density Functional Theory
Umar Y., Tijani J., Abdalla S.
PDF
(Eng)
Vol 59, No 2 (2018)
New Approach to the Analysis of Molecular Packings in Crystals with the Use of Atom-Atom Potentials
Maleev A.V., Gevorgyan A.A., Potekhin K.A.
PDF
(Eng)
Vol 57, No 8 (2016)
Density functional theory studies of conformational stabilities and rotational barriers of 2- and 3-thiophenecarboxaldehydes
Umar Y., Tijani J., Abdalla S.
PDF
(Eng)
Vol 60, No 2 (2019)
DFT-Based Molecular Conformational Analysis of a Diarylethylene Cyano-Derivative
Abulyaissova L.K.
PDF
(Eng)
Vol 59, No 1 (2018)
Variation of the Intersection Point of the Potential Surface Crossing Induced by the Laser Phase Along the Reaction Path in Ion-Molecule Reactions: Application To Li+ + CH4
Tag El-Din Kamal M., Sedik E.S., Talaat H.
PDF
(Eng)
Vol 57, No 5 (2016)
Theoretical investigation of the spectroscopic constants of aluminum carbide in the ground state
Liu X., Li L., Qian Z., Wang X.
PDF
(Eng)
Vol 60, No 1 (2019)
Conformational Space Analysis of Protected N-Formyl-L-Phenylalanine-N-Amide Amino Acid: Effects of the Intramolecular Basis Set Superposition Error
El Guerdaoui A., Tijar R., Bourjila M., El Merbouh B., El Bouzaidi R.D., El Gridani A.
PDF
(Eng)
Vol 58, No 7 (2017)
Molecular dynamics search for magic numbers for silver and copper clusters
Samsonov V.M., Vasilyev S.A., Samsonov M.V., Bembel A.G., Belotserkovskii A.V., Rybakov D.I.
PDF
(Eng)
Vol 59, No 5 (2018)
Predicted Structures and Electronic Properties of Gallium-Indium Clusters GamInn–m (n = 4, 6, 8 and m < n): A Density Functional Study
Hakkar F., Zouchoune B.
PDF
(Eng)
Vol 58, No 7 (2017)
Study of a supramolecular structure of continental type petroleum asphaltenes
Shutkova S.A., Dolomatov M.Y.
PDF
(Eng)
1 - 22 of 22 Items

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