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Cover: 9780521825689 | The Art of Molecular Dynamics Simulation | D. C. Rapaport (u. a.)
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The Art of Molecular Dynamics Simulation
Buch von D. C. Rapaport (u. a.)
Sprache: Englisch

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Beschreibung
In this Second Edition an extensive series of detailed case studies introduces the reader to solutions to a variety of problems connected with the way molecular interactions and motions determine the properties of matter. The methods are widely used in studying phenomena involving everything from the simplest of liquids to highly complex molecules such as proteins. In addition to a significant amount of new material, this edition features completely rewritten software. First Edition Hb (1996): 0-521-44561-2 First Edition Pb (1996): 0-521-59942-3
In this Second Edition an extensive series of detailed case studies introduces the reader to solutions to a variety of problems connected with the way molecular interactions and motions determine the properties of matter. The methods are widely used in studying phenomena involving everything from the simplest of liquids to highly complex molecules such as proteins. In addition to a significant amount of new material, this edition features completely rewritten software. First Edition Hb (1996): 0-521-44561-2 First Edition Pb (1996): 0-521-59942-3
Inhaltsverzeichnis
1. Introduction; 2. Basic molecular dynamics; 3. Simulating simple systems; 4. Equilibrium properties of simple fluids; 5. Dynamical properties of simple fluids; 6. Alternative ensembles; 7. Nonequilibrium dynamics; 8. Rigid molecules; 9. Flexible molecules; 10. Geometrically constrained molecules; 11. Internal coordinates; 12. Many-body interactions; 13. Long-range interactions; 14. Step potentials; 15. Time-dependent phenomena; 16. Granular dynamics; 17. Algorithms for supercomputers; 18. More about software; 19. The future.
Details
Erscheinungsjahr: 2013
Fachbereich: Theoretische Physik
Genre: Physik
Rubrik: Naturwissenschaften & Technik
Medium: Buch
Inhalt: Gebunden
ISBN-13: 9780521825689
ISBN-10: 0521825687
Sprache: Englisch
Ausstattung / Beilage: HC gerader Rücken kaschiert
Einband: Gebunden
Autor: Rapaport, D. C.
Rapaport, Dennis
Hersteller: Cambridge University Press
Maße: 260 x 183 x 35 mm
Von/Mit: D. C. Rapaport (u. a.)
Erscheinungsdatum: 10.06.2013
Gewicht: 1,244 kg
Artikel-ID: 102499716
Inhaltsverzeichnis
1. Introduction; 2. Basic molecular dynamics; 3. Simulating simple systems; 4. Equilibrium properties of simple fluids; 5. Dynamical properties of simple fluids; 6. Alternative ensembles; 7. Nonequilibrium dynamics; 8. Rigid molecules; 9. Flexible molecules; 10. Geometrically constrained molecules; 11. Internal coordinates; 12. Many-body interactions; 13. Long-range interactions; 14. Step potentials; 15. Time-dependent phenomena; 16. Granular dynamics; 17. Algorithms for supercomputers; 18. More about software; 19. The future.
Details
Erscheinungsjahr: 2013
Fachbereich: Theoretische Physik
Genre: Physik
Rubrik: Naturwissenschaften & Technik
Medium: Buch
Inhalt: Gebunden
ISBN-13: 9780521825689
ISBN-10: 0521825687
Sprache: Englisch
Ausstattung / Beilage: HC gerader Rücken kaschiert
Einband: Gebunden
Autor: Rapaport, D. C.
Rapaport, Dennis
Hersteller: Cambridge University Press
Maße: 260 x 183 x 35 mm
Von/Mit: D. C. Rapaport (u. a.)
Erscheinungsdatum: 10.06.2013
Gewicht: 1,244 kg
Artikel-ID: 102499716
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