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From Quantum to Classical Molecular ...

Lubich, Christian,

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From Quantum to Classical Molecular Dynamics: Reduced Models and Numerical Analysis

Record Type:	Electronic resources : Monograph/item
Title/Author:	From Quantum to Classical Molecular Dynamics: Reduced Models and Numerical Analysis/ Christian Lubich
Author:	Lubich, Christian,
Published:	Zuerich, Switzerland :European Mathematical Society Publishing House, : 2008,
Description:	1 online resource (153 pages)
Subject:	Numerical analysis -
Online resource:	https://doi.org/10.4171/067
Online resource:	https://www.ems-ph.org/img/books/lubich_mini.jpg
ISBN:	9783037195673

From Quantum to Classical Molecular Dynamics: Reduced Models and Numerical Analysis
Lubich, Christian,

From Quantum to Classical Molecular Dynamics: Reduced Models and Numerical Analysis[electronic resource] /Christian Lubich - Zuerich, Switzerland :European Mathematical Society Publishing House,2008 - 1 online resource (153 pages) - Zurich Lectures in Advanced Mathematics (ZLAM).

Restricted to subscribers:https://www.ems-ph.org/ebooks.php

Quantum dynamics of molecules poses a variety of computational challenges that are presently at the forefront of research efforts in numerical analysis in a number of application areas: high-dimensional partial differential equations, multiple scales, highly oscillatory solutions, and geometric structures such as symplecticity and reversibility that are favourably preserved in discretizations. This text addresses such problems in quantum mechanics from the viewpoint of numerical analysis, illustrating them to a large extent on intermediate models between the Schrödinger equation of full many-body quantum dynamics and the Newtonian equations of classical molecular dynamics. The fruitful interplay between quantum dynamics and numerical analysis is emphasized.

ISBN: 9783037195673

Standard No.: 10.4171/067doiSubjects--Topical Terms:

1245518
Numerical analysis

From Quantum to Classical Molecular Dynamics: Reduced Models and Numerical Analysis
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