[CPMD-list] problem with time

[Younes Ansari]

Dear cpmd mailing list:
 I have done wavefunction optimization and geometry optimization for 54 atoms of cesium but it took 5 days .
 I want to know if it would be possible to do different MDs by the same condition just by changing the box lenght and temperature with the same wavefunction optimization and geometry optimization. 
 
   

		
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