Dear all,
When I calculated a geometry optimization by ADF 2.3. I met with a
problem:
During the process of SCF, the program indicate that "SCF
acceptably converged , Procedure halted (very slow convergence), and then
exit out. Could anybody tell me how to do with the problem?
Thanks!
''''''''''''''''''''''''''''''''''''''''''''''''''''''''''''''''
Wan Xiaohong
Miyamoto Lab. Materials Chemistry,
School of Engineering,Tohoku Univ. Japan
email: xhwan_at_aki.che.tohoku.ac.jp
xhwan_at_hotmail.com
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Received on 2000-04-09 10:15:37
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