Dear Authors, Could you please clarify whether the Nose thermostat and velocity rescaling features in PWSCF 2.1 are working or let me know if it will be possible to get them to work. I need these to create a glass using the melt and quench MD method, but I don't wish to use the Car-Parrinello dynamics found in CP or FPMD.
Thanks, Gana ^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^ Gana Natarajan Ph. D Student Amorphous Materials Group Department of Chemistry Lensfield Road Cambridge CB2 1EW United Kingdom Tel: +44 -(01223) 336 532 Fax: +44- (01223) 336 362
