[Wien] optimization atomic positions

2014-02-25 Thread moufdi hadjab
  Hello everybody, I want to ask about the optimization of atomic positions, How to do it Thank you so much Best regards M. Hadjab ___ Wien mailing list Wien@zeus.theochem.tuwien.ac.at http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien SEARCH the

Re: [Wien] optimization atomic positions

2014-02-25 Thread Stefaan Cottenier
I want to ask about the optimization of atomic positions, How to do it See the usersguide, Sec. 5.3.2. Stefaan ___ Wien mailing list Wien@zeus.theochem.tuwien.ac.at http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien SEARCH the MAILING-LIST at: