Improving the QM/MM Description of Chemical Processes: A Dual Level Strategy To Explore the Potential Energy Surface in Very Large Systems

✍ Scribed by Martí, Sergio; Moliner, Vicente; Tuñón, Iñaki

• Book ID: 121262337
• Publisher: American Chemical Society
• Year: 2005
• Tongue: English
• Weight: 123 KB
• Volume: 1
• Category: Article
• ISSN: 1549-9618
• DOI: 10.1021/ct0501396