Search Results - "MIKHAILOV, G G"

Quantum Chemical Calculations of the Magnetic Susceptibility Tensor of Titanium Dioxide Clusters by Mikhailov, G. P.

“…The equilibrium geometry, tensors of diamagnetic, paramagnetic and magnetic susceptibility of (TiO 2 ) n clusters ( n = 1–4, 10–16) and supramolecular…”
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Mechanism of Binding of Hydrated Titanium Dioxide Nanocluster with Calcium Aqua Ion by Mikhailov, G. P.

“…The equilibrium geometry and wave functions were calculated and a quantum topological study of electron density was performed for the supramolecular complexes…”
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Quantum-Chemical Study of the Energy of Binding Lithium Endofullerene Ion Li+@C60 to Anions by Mikhailov, G. P.

“…The optimal geometry and binding energy (Δ E ) of Li + @C 60 A ‒ ion pairs (A = BF 4 , AsF 6 , PF 6 , FSI, TFSI, and 4F-BB) in vacuum and chlorobenzene medium…”
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Evidence for interacting two-level systems from the 1/f noise of a superconducting resonator by Burnett, J., Faoro, L., Wisby, I., Gurtovoi, V. L., Chernykh, A. V., Mikhailov, G. M., Tulin, V. A., Shaikhaidarov, R., Antonov, V., Meeson, P. J., Tzalenchuk, A. Ya, Lindström, T.

“…The performance of a great variety of electronic devices—ranging from semiconductor transistors to superconducting qubits—is hampered by low-frequency noise…”
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Application of a Vector–Scalar Receiver for Analysis of a Field’s Directional Properties by Mikhailov, S. G.

“…The authors investigate the possibility of studying the directional properties of a field using a single combined vector–scalar receiver. A mathematical model…”
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Modeling of the Interaction of Cations of Alkali Metals with a Fragment of Graphene in the Environment of Benzene by Mikhailov, G. P.

“…The method of density functional theory in M06-2X/6-31G( d , p ) approximation was used to simulate the interaction of cations of alkali metals (M = Li + , Na…”
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Molecular Dynamic Modeling of the Excitation of Stretching Vibrations of the OH Group of Phenol by Mikhailov, G. P.

“…The time of the redistribution of the kinetic energy of atoms by intramolecular vibrational modes (the lower boundary of V−V energy exchange) of a phenol…”
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Relationship of the Frequency of the Symmetric Stretching Vibration of the Bond of Group II–IV Metal Ions with Water Molecules and Thermodynamic Functions of Aqua Ion Formation by Mikhailov, G. P.

“…Density functional theory in the M062x/6-311+G(d,p) approximation was used to calculate the optimal geometry and Raman spectra of group II–IV metal aqua ions…”
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Improvement of Multidimensional Randomized Monte Carlo Algorithms with “Splitting” by Mikhailov, G. A.

“…Randomized Monte Carlo algorithms are constructed by jointly realizing a baseline probabilistic model of the problem and its random parameters (random medium)…”
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Relationship Between the Shift of Frequency ν(OH) and the Characteristics of the Electron Density Distribution of the Hydrogen Bond of Oxy Anions with a Water Molecule by Mikhailov, G. P.

“…The optimal geometry, vibrational spectra, and wave functions of 33 oxy anion complexes HOH…A − are calculated by density functional theory in the…”
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Randomized Monte Carlo Algorithms for Problems with Random Parameters (“Double Randomization” Method) by Mikhailov, G. A.

“…Randomized Monte Carlo algorithms are constructed by a combination of a basic probabilistic model and its random parameters to investigate parametric…”
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New Computer Efficient Approximations of Random Functions for Solving Stochastic Transport Problems by Mikhailov, G. A., Medvedev, I. N.

“…A new grid approximation of a homogeneous isotropic random field with a given average correlation length is developed. The approximation is constructed by…”
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Numerical-Statistical Investigation of Superexponential Growth of Mean Particle Flow with Multiplication in a Homogeneous Random Medium by Mikhailov, G. A., Lotova, G. Z.

“…A new correlative-grid approximation of a homogeneous random field is introduced for an effective numerical-analytical investigation of the superexponential…”
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Thermochemistry of Complex Formation of Endofullerene Li+@C60 with the Triflate Ion by Mikhailov, G. P.

“…The density functional theory method at the M06-2X/6-31G(d,p) level was used to calculate the optimal geometry and thermodynamic parameters of formation of the…”
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Analysis of the Electron Density Laplacian of Lithium Complexes of Polycyclic Aromatic Hydrocarbons by Mikhailov, G. P.

“…According to DFT/M06-2X/6-311G(d,p) calculations, the binding energy of the lithium cation with benzene and polycyclic aromatic hydrocarbons of the general…”
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Investigation of Overexponential Growth of Mean Particle Flux with Multiplication in Random Medium by Lotova, G. Z., Mikhailov, G. A.

“…A new correlative-grid approximation for a homogeneous isotropic random field of density is introduced for effective numerical-analytical investigation of…”
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Thermodynamics of the Formation of Complexes and the Hydrogen Bonds between Oxyanions and Water by Mikhailov, G. P.

“…The most stable structures of 32 complexes containing oxyanions with HOH···A − are optimized according to density functional theory M06-2X with basis set…”
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Thermodynamic Analysis of the Processes in the High-Temperature Multicomponent Fe–Y–Si–O–C System by Mikhailov, G. G., Makrovets, L. A.

“…Special complex alloys of rare earth metals are recommended to perform deoxidation, microalloying, and modification in the production of low-carbon and…”
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Study of Superexponential Growth of the Mean Particle Flux by Monte Carlo Method by Lotova, G. Z., Mikhailov, G. A.

“…A comparative analysis of two algorithms (“by particles” and “by collisions”) for estimation of the weighted mean particle flux is made on the basis of a test…”
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Numerical-Statistical and Analytical Study of Asymptotics for the Average Multiplication Particle Flow in a Random Medium by Lotova, G. Z., Mikhailov, G. A.

“…It is well known that, under rather general conditions, the particle flux density in a multiplying medium is asymptotically exponential in time with a…”
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