Methods in Computational Molecular Physics.pdf

Methods in Computational Molecular Physics

This volume records the lectures given at a NATO Advanced Study Institute on Methods in Computational Molecular Physics held in Bad Windsheim, Germany, from 22nd July until 2nd. August, 1991. This NATO Advanced Study Institute sought to bridge the quite considerable gap which exist between the presentation of molecular electronic structure theory found in contemporary monographs such as, for example, McWeenys Methods 0/ Molecular Quantum Mechanics (Academic Press, London, 1989) or Wilsons Electron correlation in moleeules (Clarendon Press, Oxford, 1984) and the realization of the sophisticated computational algorithms required for their practical application. It sought to underline the relation between the electronic structure problem and the study of nuc1ear motion. Software for performing molecular electronic structure calculations is now being applied in an increasingly wide range of fields in both the academic and the commercial sectors. Numerous applications are reported in areas as diverse as catalysis and interstellar chernistry, drug design and environmental studies, molecular biology and solid state physics. The range of applications continues to increase as scientists recognize the importance of molecular structure studies to their research activities. Recent years have seen a growing dependence of these applications on program packages, which are often not in the public domain and which may have a somewhat lirnited range of applicability dicta ted by the particular interests and prejudices of the program author.

Methods in Computational Molecular Physics: …

7.54 MB DATEIGRÖSSE
1461574218 ISBN
Englisch SPRACHE
Methods in Computational Molecular Physics.pdf

Technik

PC und Mac

Lesen Sie das eBook direkt nach dem Herunterladen über "Jetzt lesen" im Browser, oder mit der kostenlosen Lesesoftware Adobe Digital Editions.

iOS & Android

Für Tablets und Smartphones: Unsere Gratis tolino Lese-App

Andere eBook Reader

Laden Sie das eBook direkt auf dem Reader im Hugendubel.de-Shop herunter oder übertragen Sie es mit der kostenlosen Software Sony READER FOR PC/Mac oder Adobe Digital Editions.

Reader

Öffnen Sie das eBook nach der automatischen Synchronisation auf dem Reader oder übertragen Sie es manuell auf Ihr tolino Gerät mit der kostenlosen Software Adobe Digital Editions.

Aktuelle Bewertungen

avatar
Sofia Voigt

Methods in Computational - GBV

avatar
Matteo Müller

Methods in Computational Molecular Physics … Methods in Computational Molecular Physics Nato Science Series C: Amazon.es: Geerd H.F. Diercksen, Stephen Wilson: Libros en idiomas extranjeros. Saltar al contenido principal . Prueba Prime Hola, Identifícate Cuenta y listas Identifícate Cuenta y listas Pedidos Suscríbete a Prime Cesta. Todos los departamentos

avatar
Noel Schulze

Students will learn basic elements of computational methods and acquire hands-on experience in their practical use in the context of computer simulations to solve physics problems. Molecular dynamics simulation of the oxidation of an aluminum nanoparticle. Announcements. 1/13 (M): Class begins. 1/20 (M): MLK Birthday--no class. Journal of Computational Methods in Molecular …

avatar
Jason Lehmann

Molecular mechanics simulations use the laws of classical physics to predict the structures and properties of molecules. They are many different molecular ...

avatar
Jessica Kohmann

Computational Physics, Course 509 - Physics …