Molecular dynamics

Molecular dynamics: with deterministic and stochastic numerical methods

by Leimkuhler, B.

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Title Statements

  • Full title :Molecular dynamics : with deterministic and stochastic numerical methods / Ben Leimkuhler, Charles Matthews.

Edition Statements

  • Publication Date:2015.

Publication Statements

  • Publisher(s):Springer
  • Place of Publication:Cham
  • Language:eng
  • Publication Date:2015.

Notes

Titre de l'écran-titre (visionné le 3 juillet 2015).

The Physical Object

  • Description:1 ressource en ligne (xxii, 443 pages) : : illustrations en partie en couleur, fichiers PDF

Edition Identifiers

  • ISBN:9783319163758, 3319163752
  • oclc:on1132131221
  • LC Classification:QP517.M65
  • Dewey Decimal:541/.394

Table of Contents

1. Introduction -- 2. Numerical Integrators -- 3. Analyzing Geometric Integrators -- 4. The Stability Threshold -- 5. Phase Space Distributions and Microcanonical Averages -- 6. The Canonical Distribution and Stochastic Differential Equations -- 7. Numerical Methods for Stochastic Molecular Dynamics -- 8. Extended Variable Methods -- References -- Index.

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Subjects

Dynamique moléculaire Molecular dynamics

Writers

Leimkuhler, B. Matthews, Charles, (Statisticien)

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