Subject: CCL: Assigning basis set atom by atom

From: Ian Hovell <HOVELL$at$cetem.gov.br>
Date: Wed, 19 May 2004 09:32:56 -0300

Dear CCLers,
Using hyper chem it is possible to assign basis set atom by atom in a
molecule. I would like to do this using Gaussian. Apart from performing a
ONIOM calculation is there a way of doing this? And if so how. 
As all ways I will post a summary.
Ian Hovell - Ph.D. 
NUCLEO DE MODELAGEM MOLECULAR-NMM 
Centro de Tecnologia Mineral - CETEM 
Ministerio da Cijncia e da Tecnologia- MCT 
Avenida Ipj, No 900 - Cidade Universitaria 
Ilha do Fundco Rio de Janeiro RJ Brasil 
CEP 21941-590 
tel 00 55 (xx) 3865 7344 ou 3865 - 7216 
Fax 00 55 (xx) 22602837 ou 2290-4286 
e-mail hovell$at$cetem.gov.br <mailto:hovell$at$cetem.gov.br>