Modern Methods and Algorithms of Quantum Chemistry
by Johannes Grotendorst
Publisher: NIC 2000
Number of pages: 638
This interdisciplinary Winterschool brought together experts from the fields of quantum chemistry, computer science and applied mathematics in order to present recent methodological and computational advances to research students in the field of theoretical chemistry and their applications.
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by Charles Marius Deventer - John Wiley & Sons
The author has endeavored to collect the most important results of physical chemistry in such a manner that this important branch of modern chemistry may be accessible to those who have not made an exhaustive study of physics and mathematics.
This is a book on computer simulation of matter. The book is built on the framework of statistical thermodynamics. It is intended to serve as the textbook for an advanced undergraduate / graduate physical chemistry course in molecular simulation.
by Walter John Moore
An account of physical chemistry for students of science and engineering. The treatment is more precise than is customary in elementary books, and most of the relationships have been given at least a heuristic derivation from fundamental principles.
by C. David Sherrill - Georgia Institute of Technology
The ebook covers the motivation for quantum mechanics, Schrödinger equation, postulates of quantum mechanics, some analytically soluble problems, approximate methods, molecular quantum mechanics, solving the electronic eigenvalue problem.