[Pw_forum] constrained molecular dynamics

[Paolo Giannozzi]

On Jan 14, 2008, at 17:18 , Devis Di Tommaso wrote:

> is it possible to perform constrained molecular dynamics
> simulation with the present version of CP?

at least a few constraints are implemented. Please have
a look at the input documentation for CP (INPUT_CP)
for cards CONSTRAINTS

Paolo
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Paolo Giannozzi, Dept of Physics, University of Udine
via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222