Alternative algorithms for optimizing an ellipsoidal cavity in self-consistent reaction field calculations. Example of an organometallic complex
Thierry Visentin, Alain Dedieu, Elise Kochanski, Lilyane PadelVolume:
459
Year:
1999
Language:
english
Pages:
14
DOI:
10.1016/s0166-1280(98)00268-1
File:
PDF, 281 KB
english, 1999