Molecular Dynamics

Name: Molecular Dynamics
Brand: Springer International Publishing AG
SKU: 9783319163741
Price: 1717 CZK
Availability: InStock

With Deterministic and Stochastic Numerical Methods

Autor: Ben Leimkuhler, Charles Matthews

Jazyk:

Vazba: Pevná

Vydavatel: Springer International Publishing AG

Dostupnost: Skladem u dodavatele

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1 717 Kč

This book describes the mathematical underpinnings of algorithms used for molecular dynamics simulat...

Informace o knize

Autor

Ben Leimkuhler, Charles Matthews

Jazyk

Angličtina

Vazba

Kniha - Pevná

Vydáno

2015

Stránek

443

EAN

9783319163741

ISBN

3319163744

Enbook ID

09205078

Vydavatel

Springer International Publishing AG

Hmotnost

856

Rozměry

161 x 237 x 31

Kompletní popis

This book describes the mathematical underpinnings of algorithms used for molecular dynamics simulation, including both deterministic and stochastic numerical methods. Molecular dynamics is one of the most versatile and powerful methods of modern computational science and engineering and is used widely in chemistry, physics, materials science and biology. Understanding the foundations of numerical methods means knowing how to select the best one for a given problem (from the wide range of techniques on offer) and how to create new, efficient methods to address particular challenges as they arise in complex applications.§§Aimed at a broad audience, this book presents the basic theory of Hamiltonian mechanics and stochastic differential equations, as well as topics including symplectic numerical methods, the handling of constraints and rigid bodies, the efficient treatment of Langevin dynamics, thermostats to control the molecular ensemble, multiple time-stepping, and the dissipative particle dynamics method.§

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Molecular Dynamics

With Deterministic and Stochastic Numerical Methods

Informace o knize

Kompletní popis

Mohlo by vás zajímat

Zákaznicí kteří koupili tuto knihu koupili také