ТЕОРЕТИЧЕСКАЯ НЕОРГАНИЧЕСКАЯ ХИМИЯ

Issue Title File
Vol 69, No 9 (2024) Spin properties of chiral SiC nanotubes PDF
(Rus)
Dyachkov P.N., Kulyamin P.A.
Vol 69, No 6 (2024) Quantum‒Chemical Simulation of Molecular Hydrogen Abstraction from Magnesium Borohydride Diammoniate PDF
(Rus)
Zyubin A.S., Zyubina T.S., Kravchenko O.V., Solov’ev M.V., Vasiliev V.P., Zaitsev A.A., Shikhovtsev A.V., Dobrovol’sky Y.A.
Vol 69, No 5 (2024) Quantum chemical modeling of supertetrahedral crystal structures containing C4 and X4 (X = B, Al, Ga) tetrahedra PDF
(Rus)
Getmanskii I.V., Zaitsev S.А., Koval V.V., Minyaev R.М.
Vol 69, No 5 (2024) Computer simulation of the properties and structure of crystalline 1,6-closo-carborane (С2B4)n PDF
(Rus)
Zaitsev S.А., Zaitseva Y.I., Getmanskiy I.V., Minyaev R.М.
Vol 69, No 5 (2024) Spin properties of silicon-germanium nanotubes PDF
(Rus)
D’yachkov Е.P., Merinov V.B., D’yachkov P.N.
Vol 69, No 4 (2024) Electronic Structure Of Cobalt Phosphates Co1-xmxpo4 Doped With Iron And Nickel Atoms PDF
(Rus)
Pecherskaya M.D., Galkina O.A., Ruzimuradov O.N., Mamatkulov S.I.
Vol 68, No 11 (2023) Derivation of a Force Field for Computer Simulations of Multi-Walled Nanotubes Using Genetic Algorithm. I. Tungsten Disulfide PDF
(Rus)
Bandura A.V., Lukyanov S.I., Domnin A.V., Kuruch D.D., Evarestov R.A.
Vol 68, No 10 (2023) Spin Selectivity of the Conductivity of Gold Nanotubes according to the Cylindrical Wave Method Data PDF
(Rus)
D’yachkov P.N., D’yachkov E.P.
Vol 68, No 10 (2023) Nonempirical Modeling of Interactions of Fe2O2 and Fe2O4 Clusters with H2 and O2 Molecules PDF
(Rus)
Bozhenko K.V., Utenyshev A.N., Gutsev L.G., Gutsev G.L., Aldoshin S.M.
Vol 68, No 8 (2023) Initial Stages of the Formation of the Supramolecular Structure of Ca and Mg Oxides PDF
(Rus)
Sakovich R.A., Shaulov A.Y.
Vol 68, No 7 (2023) Effect of Torsional Deformations on the Spin States of Carbon Nanotubes with Metallic Conductivity PDF
(Rus)
D’yachkov E.P., Lomakin N.A., D’yackov P.N.
Vol 68, No 5 (2023) Prediction of the Melting Points of Double Halides PDF
(Rus)
Kiseleva N.N., Dudarev V.A., Stolyarenko A.V., Dokukin A.A., Sen’ko O.V., Kuznetsova Y.O.
Vol 68, No 4 (2023) Simulation of Spin Selectivity of Electrical Conductivity of Chiral Platinum Nanotubes PDF
(Rus)
D’yachkov P.N., Lomakin N.A.
Vol 68, No 4 (2023) DFT Modeling of Isomerism of Doped Mg24L2 Clusters with Dopants L at the Surface and inside the Magnesium Cage PDF
(Rus)
Charkin O.P.
Vol 68, No 2 (2023) Equation of State of Periclase Based on Planck–Einstein Functions PDF
(Rus)
Perevoshchikov A.V., Maksimov A.I., Babayan I.I., Kovalenko N.A., Uspenskaya I.A.
Vol 68, No 1 (2023) Sodium-Stabilized Hexagonal Borophene: Structure, Stability, and Electronic and Mechanical Properties PDF
(Rus)
Steglenko D.V., Gribanova T.N., Minyaev R.M., Minkin V.I.
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