An adaptive density-guided approach for the generation of potential energy surfaces of polyatomic molecules
Author:
Publisher
Springer Science and Business Media LLC
Subject
Physical and Theoretical Chemistry
Link
http://link.springer.com/content/pdf/10.1007/s00214-009-0532-1.pdf
Reference50 articles.
1. Carter S, Culik SJ, Bowman JM (1997) J Chem Phys 107:10458
2. Kongsted J, Christiansen O (2006) J Chem Phys 125:124108
3. Bowman JM, Carter S, Huang XC (2003) Int Rev Phys Chem 22:533
4. Jung JO, Gerber RB (1996) J Chem Phys 105:10332
5. Rauhut G (2004) J Chem Phys 121:9313
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