Dear ADF-Users,
I'm trying to do a solvent optimisation of Ir(H2O)63+ ion with ADF 2000 and
I'd like to know if it is possible to do a simple SCRF optimisation or if
there is only the COSMO possibility.
Could someone give me some advices about COSMO jobs ?
I wish a merry Christmas to ADF hard-workers.
Greetings,
D. De Vito
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D. De Vito
Enseignant de Chimie et d'Informatique, Adjoint au Bureau de Gestion
Collège Rousseau
16A, Avenue du Bouchet
Case Postale 216
1211 Genève 28
Suisse
+4122 / 733.71.30 (Collège)
+4122 / 733.71.82 (Fax)
http://lcta.unige.ch/~devito (Page personnelle)
http://wwwedu.ge.ch/po/rousseau (Site officiel du Collège)
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Received on 2002-01-07 12:30:35
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