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A Guide to Molecular Mechanics and Quantum Chemical Calculations

Posted By: Underaglassmoon
A Guide to Molecular Mechanics and Quantum Chemical Calculations

A Guide to Molecular Mechanics and Quantum Chemical Calculations
Wavefunction | Chemistry, Physics, Mechanics | Jan. 1 2003 | ISBN-10: 189066118X | 816 pages | pdf | 13.4 mb

This book derives from materials and experience accumulated at Wavefunction and Q-Chem over the past several years. PhilipKlunzinger and Jurgen Schnitker at Wavefunction and Martin Head-Gordon and Peter Gill at Q-Chem warrant special mention, but thebook owes much to members of both companies, both past andpresent. Special thanks goes to Pamela Ohsan and Philip Keck for turning a “sloppy manuscript” into a finished book.