The potential energy surface for the oxywater radical cation transformation to hydrogen peroxide radical cation studied by density functional theory and ab initio methods. Are hybrid density functional methods as accurate as coupled-cluster ab initio methods?

✍ Scribed by Branko S. Jursic

• Book ID: 114142233
• Publisher: Elsevier Science
• Year: 1997
• Tongue: English
• Weight: 812 KB
• Volume: 401
• Category: Article
• ISSN: 0166-1280
• DOI: 10.1016/s0166-1280(96)04980-9