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卷 57, 编号 6 (2016)
Molecular dynamics study of self-radiation damage in mineral matrices
Grechanovsky A., Urusov V., Eremin N.
PDF
(Eng)
卷 59, 编号 2 (2018)
Structure of Aqueous Solutions of Trimethylaminoxide, Urea, and Their Mixture
Kadtsyn E., Anikeenko A., Medvedev N.
PDF
(Eng)
卷 58, 编号 7 (2017)
Structure of a Na+ cation hydration shell on heating in a planar nanopore
Shevkunov S.
PDF
(Eng)
卷 57, 编号 6 (2016)
New gadolinium polyselenide GdSe1.89(6) in the PbFCl matlockite structure type
Zelenina L., Chusova T., Podberezskaya N., Korolkov I., Piryazev D.
PDF
(Eng)
卷 57, 编号 4 (2016)
Effect of the calculation method and the basis set on the structure and electrical properties of (4,4) carbon nanotubes with different lengths and open ends
Butyrskaya E., Zapryagaev S., Nechaeva L., Karpushin A., Izmailova E.
PDF
(Eng)
卷 60, 编号 10 (2019)
Thermodynamic and Structural Characteristics of SPC/E Water at 290 K and under High Pressure
Teplukhin A.
PDF
(Eng)
卷 59, 编号 8 (2018)
Structure and Morphology of Cds Nanoparticles
Evtushok B., Cherepanova S., Kozlova E.
PDF
(Eng)
卷 58, 编号 6 (2017)
X-ray spectroscopy study of lithiated graphite obtained by thermal deposition of lithium
Lapteva L., Fedoseeva Y., Gevko P., Smirnov D., Gusel’nikov A., Bulusheva L., Okotrub A.
PDF
(Eng)
卷 57, 编号 6 (2016)
Structure of liquid chlorobenzene in the temperature range 293-363 K
Alekseev E., Bogdan T.
PDF
(Eng)
卷 57, 编号 3 (2016)
In silico study of the atomic and electronic structure of quantum dots of the CdTe family doped with atoms of rare earth elements
Kravtsova A., Suchkova S., Fayn M., Soldatov A.
PDF
(Eng)
卷 60, 编号 8 (2019)
Molecular Dynamics Simulation of the Aging Process of the Cysteine-Silver Solution
Malyshev M., Baburkin P., Adamyan A., Khizhnyak S., Pakhomov P., Komarov P.
PDF
(Eng)
卷 59, 编号 7 (2018)
Monte Carlo Simulation of the Local Ordering of Water Molecules. II. Spatial Correlations and Hydrogen Bonds
Teplukhin A.
PDF
(Eng)
卷 58, 编号 2 (2017)
Role of the conservative interhelical hydrogen bond Ser74–Trp158 at the cholesterol binding site in the conformational stability of the β2-adrenergic receptor: Molecular dynamics simulation
Bogdan T., Alekseev E.
PDF
(Eng)
卷 57, 编号 6 (2016)
Structure of zirconium tetrahydroborate Zr(BH4)4: A molecular dynamics study
Igoshkin A., Golovnev I., Krisyuk V., Igumenov I.
PDF
(Eng)
卷 57, 编号 1 (2016)
Phenomenon of the ousting of a monatomic ion from its hydration shell in flat nanopores
Shevkunov S.
PDF
(Eng)
卷 60, 编号 5 (2019)
Investigation of Lithium-Ion Diffusion in LiCoPO4 Cathode Material by Molecular Dynamics Simulation
Dehghan F., Mohammadi-Manesh H., Loghavi M.
PDF
(Eng)
卷 59, 编号 6 (2018)
Simulation of Pyramidal Inversion of Nitrogen in Tetrahydro-1,3-Oxazines in Polar Medium
Kuznetsov V.
PDF
(Eng)
卷 58, 编号 2 (2017)
Simulation of glycyrrhizic acid associates with cholesterol in methanol
Anikeenko A., Zelikman M., Kadtsyn E., Medvedev N.
PDF
(Eng)
卷 57, 编号 8 (2016)
Halogen aggregation in chlorobenzene-o-dichlorobenzene solutions
Alekseev E., Bogdan T.
PDF
(Eng)
卷 60, 编号 3 (2019)
The Structure of Water Condensate Nuclei in the Field of Surface Crystalline Defects on the Basal Face of β-AgI
Shevkunov S.
PDF
(Eng)
卷 59, 编号 6 (2018)
Thermodynamically Motivated Criterion of Hydrogen Bonds in Water Simulations
Teplukhin A.
PDF
(Eng)
卷 58, 编号 2 (2017)
Computer simulation of amino acid sorption on carbon nanotubes
Nechaeva L., Butyrskaya E., Zapryagaev S.
PDF
(Eng)
卷 57, 编号 8 (2016)
Electronic structure and magnetic properties of hexagonal and cubic forms of aluminum nitride doped with sp impurities (B, C, O)
Bannikov V., Kudyakova V., Elagin A., Baranov M., Beketov A.
PDF
(Eng)
卷 60, 编号 1 (2019)
Molecular Cycles (H2O)n on the Substrates with Hexagonal Crystal Structure
Shevkunov S.
PDF
(Eng)
卷 59, 编号 6 (2018)
Modification of the Optical and Electronic Properties of TiO2 By N Anion-Doping for Augmentation of the Visible Light Assisted Photocatalytic Performance
Zhang D., Wang J.
PDF
(Eng)
卷 58, 编号 1 (2017)
Local atomic and electronic structure of quantum dots based on Mn- and Co-doped ZnS
Kravtsova A., Budnik A., Pankin I., Lastovina T., Bugaev A., Popov L., Soldatov M., Butova V., Soldatov A.
PDF
(Eng)
卷 57, 编号 5 (2016)
Structure of small associates of glycyrrhizic acid with cholesterol in aqueous solution: Molecular dynamics simulation
Zelikman M., Kim A., Medvedev N.
PDF
(Eng)
卷 59, 编号 3 (2018)
Water Structure in the Contact Layer on the Surface of Crystalline Silver Iodine
Shevkunov S.
PDF
(Eng)
卷 58, 编号 8 (2017)
Effect of synthesis conditions on the structure and properties of new SiCxNyMz materials for spintronics
Fainer N., Pushkarev R., Shestakov V., Gutakovskii A.
PDF
(Eng)
卷 58, 编号 1 (2017)
Quantum chemical simulation of low-basic AN-221(НСl) anion exchanger during the hydration and non-exchangeable absorption of phenylalanine
Trunaeva E., Khokhlova O., Khokhlov V.
PDF
(Eng)
卷 57, 编号 5 (2016)
Structure and some physicochemical properties of carbon and silicon phases with a LA3 diamond-like lattice
Belenkov E., Greshnyakov V.
PDF
(Eng)
卷 59, 编号 2 (2018)
Formation of Compressed and Mixed-Layered Graphite on Heating Impact Diamonds
Gromilov S., Nikolaev R., Cherepanova S.
PDF
(Eng)
卷 58, 编号 8 (2017)
Thermodynamic simulation and experimental investigation of reactive chemical vapor deposition in the Ta–C–Si–O–F system
Lozanov V., Baklanova N., Piryazev D.
PDF
(Eng)
卷 57, 编号 4 (2016)
Electronic structure of non-stoichiometric ZrCuSiAs-like layered LaZnAsO1–δ compositions: FLAPW-GGA modeling
Bannikov V., Shein I.
PDF
(Eng)
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