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Please give me your help.

Posted: Tue Jan 15, 2008 1:50 pm
by matylove
I want to make the structure of amorphous SiO2
Most people use MD simulation to get structures of amorphous. but I don't have that program.
can I make the structure of amorphous SiO2 by using VASP??
If it is possible, please tell me about that.
I'm looking forward to getting your heip.

Please give me your help.

Posted: Mon Jan 28, 2008 9:55 am
by admin
please use IBRION=0 to do an MD (you can find a detailled discussion on how to do MD with vasp in the online handbook, in the exapmles section)