Density Functional Theory Chapters

abstract

• The book examines molecular mechanics, semi-empirical methods, wave function-based quantum chemistry, density functional theory, 3-D structure generation, and hybrid methods.

authors

• Ayers, Paul
• Yang, W

status

• published 

publication date

• December 17, 2003

published in

• ChemInform  Journal

keywords

• Science

Digital Object Identifier (DOI)

• 10.1002/chin.200428293

International Standard Book Number (ISBN) 10

• 0824758633

International Standard Book Number (ISBN) 13

• 9780824758639

start page

• 571

end page

• 616

volume

• 35