by Brian E. Conway (Editor), Ralph E. White (Editor), Costas G. Vayenas (Editor)
This lucid chapter is addressed to all electrochemists, including those with very little prior exposure to quantum chemistry, and demonstrates the usefulness of ab initio calculations, including density functional theory (DFT) methods, to understand several key aspects of fuel cell electrocatalysis at the molecular level.
Format: Hardcover
Pages: 332
Edition: 2003
Publisher: Springer
Published: 30 Nov 2002
ISBN 10: 0306474921
ISBN 13: 9780306474927