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World Scientific Publishing Company

Computer Simulations of Molecules and Condensed Matter : From Electronic Structures to Molecular Dynamics

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Product Code: 9789813230446
ISBN13: 9789813230446
Condition: New
$108.85

Computer Simulations of Molecules and Condensed Matter : From Electronic Structures to Molecular Dynamics

$108.85
 
Introduction to computer simulations of molecules and condensed matter -- Quantum chemistry methods and density-functional theory -- Pseudopotentials, full potential, and basis sets -- Many-body Green function theory and the GTV approximation -- Molecular dynamics -- Extension of molecular dynamics, enhanced sampling and the free-energy calculations -- Quantum nuclear effects


Author: Xinzheng Li, En-Ge Wang
Publisher: World Scientific Publishing Company
Publication Date: Mar 08, 2018
Number of Pages: 280 pages
Language: English
Binding: Hardcover
ISBN-10: 9813230444
ISBN-13: 9789813230446
 

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