[Pw_forum] Nose thermostat

Gana Natarajan gn203 at cam.ac.uk
Wed Nov 24 12:25:34 CET 2004


Dear all,
I wish to use the Nose thermostat for MD creation of a glass using pwscf 
2.1. The input option 'nose' for  the ion_temperature keyword is not 
recognised but there seem to be routines in pwscf for the Nose 
thermostat. Please clarify this and let me know if it is possible to use 
the Nose thermostat.

Thanks,
Gana



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