Search Results - "Lakhno, V.D."
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A new approach to microscopic modeling of a hole transfer in heteropolymer DNA
Published in Chemical physics letters (15-09-2011)“…[Display omitted] ►We studied a hole transfer in d (GAGG) sequence in the Peyrard–Bishop–Holstein model. ► The thermal motion was simulated by stochastic…”
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2
Internal dynamics of a polaron uniformly moving along a molecular chain in a constant electric field
Published in Chaos, solitons and fractals (01-05-2024)“…This paper presents a detailed study of the uniform motion of a Holstein polaron as it moves along a chain in a constant electric field. The calculations…”
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3
On the thermodynamics of DNA double strand in the Peyrard-Bishop-Dauxois model
Published in Physics letters. A (28-06-2024)“…The temperature dependence of energy, partition function, entropy and free energy, describing a first-order-like phase transition of a DNA molecule is…”
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4
Correlation effects and configuration of a one-dimensional bipolaron
Published in Physics letters. A (16-12-2019)“…•Electronic correlations play a decisive role in stabilizing 1D bipolaron.•1D bipolaron can be stable in both one-center and two-center…”
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5
Translation-invariant bipolarons and the problem of high-temperature superconductivity
Published in Solid state communications (01-04-2012)“…It is shown that the bipolaron ground state is described by a delocalized wave function. For a two-parameter wave function, the lowest variation estimate of…”
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6
The direct investigation of DNA denaturation in Peyrard-Bishop-Dauxois model by molecular dynamics method
Published in Chemical physics letters (16-07-2019)“…[Display omitted] •The collisional MD-method is first used to calculate the melting of a DNA molecule.•The temperature dependence of the heat capacity has a…”
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7
Translation invariant theory of polaron (bipolaron) and the problem of quantizing near the classical solution
Published in Journal of experimental and theoretical physics (01-06-2013)“…A physical interpretation of translation-invariant polarons and bipolarons is presented, some results of their existence are discussed. Consideration is given…”
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8
A new type of localized fast moving electronic excitations in molecular chains
Published in Physica. E, Low-dimensional systems & nanostructures (01-06-2014)“…It is shown that in a Holstein molecular chain placed in a strong longitudinal electric field some new types of excitations can arise. These excitations can…”
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Superconducting Properties of 3D Low-Density Translation-Invariant Bipolaron Gas
Published in Advances in condensed matter physics (01-01-2018)“…Consideration is given to thermodynamical properties of a three-dimensional Bose-condensate of translation-invariant bipolarons (TI-bipolarons). The critical…”
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10
Energy and critical ionic-bond parameter of a 3D large-radius bipolaron
Published in Journal of experimental and theoretical physics (01-05-2010)“…A theory of a strong-coupling large-radius bipolaron has been developed. The possibility of the formation of 3D bipolarons in high-temperature superconductors…”
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11
Dynamical polaron theory of the hydrated electron
Published in Chemical physics letters (02-04-2007)“…A dynamical polaron theory of the hydrated electron is developed. The theory fairly precisely reproduces the absorbance curves for the ground and wet states of…”
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12
On the cutoff parameter in the translation-invariant theory of the strong coupling polaron (response to comments [8] on the paper V.D. Lakhno, SSC 152 (2012) 621)
Published in Solid state communications (01-10-2012)“…The paper is a reply to the arguments adduced by the authors of [8] against the results obtained by the author in [6,7]. It is shown that these arguments are…”
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13
Closed systems of equations of correlation functions of currents for heterogeneous DNA fragments and polarons
Published in Computational and theoretical chemistry (01-06-2017)“…[Display omitted] •A closed system of equations is obtained to identify conductivity control parameters for DNA fragments.•It is demonstrated that adjacent…”
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14
On the dynamics of a polaron in a classical chain with finite temperature
Published in Journal of experimental and theoretical physics (01-01-2015)“…In today’s literature, polaron states in classical molecular chains are mostly calculated at zero temperature. It is assumed that the properties of these…”
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15
Electron motion in a Holstein molecular chain in an electric field
Published in The European physical journal. B, Condensed matter physics (01-01-2011)“… A charge motion in an electric field in a Holstein molecular chain is modeled in the absence of dissipation. It is shown that in a weak electric field a…”
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16
On the path length of an excess electron interacted with optical phonons in a molecular chain
Published in Physics letters. A (25-08-2008)“…We show that in a molecular chain with dispersionless phonons at zero temperature, a “quasistationary” moving soliton state of an excess electron is possible…”
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17
Bipolarons in homogeneous DNA duplexes
Published in Chemical physics letters (17-02-2011)“…► We have shown that the bipolaronic model can explain experiments on DNA superconductivity. ► The transition temperature depends on the parameter values of…”
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18
On the calculation of thermodynamic quantities in the Holstein model for homogeneous polynucleotides
Published in Journal of experimental and theoretical physics (01-04-2017)“…The dynamics of a system for different types of polarons, i.e., in polythymine nucleotides (large-radius polaron), in polyadenine fragments (small-radius…”
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19
The virial theorem and the ground state problem in polaron theory
Published in Journal of experimental and theoretical physics (01-05-2012)“…The virial theorem for the translation-invariant theory of a polaron [3] is discussed. It is shown that, in [3], Tulub made a nonoptimal choice of variational…”
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20
Combined hopping–superexchange model of a hole transfer in DNA
Published in Chemical physics letters (11-12-2004)“…Relative hole transfer rates in DNA have been investigated in a number of nucleotide sequences experimentally. Calculation of the transfer rates in DNA is…”
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