Computational Materials Chemistry Methods and Applications /

• Corporate Author: SpringerLink (Online service)
• Other Authors: Curtiss, L.A (Editor), Gordon, M.S (Editor)
• Format: Electronic eBook
• Language: English
• Published: Dordrecht : Springer Netherlands, 2005.
• Subjects: Materials science.; Polymers.; Materials Science.; Materials Science, general.; Polymer Sciences.

As a result of the advancements in algorithms and the huge increase in speed of computers over the past decade, electronic structure calculations have evolved into a valuable tool for characterizing surface species and for elucidating the pathways for their formation and reactivity. It is also now p...