[CPMD-list] Constant pressure with BO dynamics

Gana Natarajan gn203 at cam.ac.uk
Fri Aug 12 08:59:14 CEST 2005


Dear list members,

I would like to perform a constant-pressure molecular dynamics run using 
Born-Oppenheimer dynamics, could somebody tell me if it is possible.

Thank you.

Regards,
Gana



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