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Quantum Generalization of Molecular Dynamics Method. Wigner Approach

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Computational Science and Its Applications – ICCSA 2004 (ICCSA 2004)

Part of the book series: Lecture Notes in Computer Science ((LNCS,volume 3044))

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Abstract

The new method for solving Wigner-Liouville’s type equations and studying dynamics of quantum particles has been developed within the Wigner formulation of quantum statistical mechanics. This approach combines both molecular dynamics and Monte Carlo methods and computes traces and spectra of the relevant dynamical quantities. Considering, as an application, the quantum dynamics of an ensemble of interacting electrons in an array of random scatterers clearly demonstrates that the many-particle interaction between the electrons can lead to an enhancement of the electrical conductivity.

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© 2004 Springer-Verlag Berlin Heidelberg

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Filinov, V., Bonitz, M., Fortov, V., Levashov, P. (2004). Quantum Generalization of Molecular Dynamics Method. Wigner Approach. In: Laganá, A., Gavrilova, M.L., Kumar, V., Mun, Y., Tan, C.J.K., Gervasi, O. (eds) Computational Science and Its Applications – ICCSA 2004. ICCSA 2004. Lecture Notes in Computer Science, vol 3044. Springer, Berlin, Heidelberg. https://doi.org/10.1007/978-3-540-24709-8_43

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  • DOI: https://doi.org/10.1007/978-3-540-24709-8_43

  • Publisher Name: Springer, Berlin, Heidelberg

  • Print ISBN: 978-3-540-22056-5

  • Online ISBN: 978-3-540-24709-8

  • eBook Packages: Springer Book Archive

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