[Pw_forum] About relaxation and cpmd

oulihui666 oulihui666 at 126.com
Tue Dec 25 10:09:17 CET 2007

Dear all,
    I have a naive problem, and need your help. I have not understanded this problem 
for a long time, etc. the difference between relaxation and molecular dynamics(cpmd), I 
think that there is many steps in the process of relaxation, and every step denotes 
a intermediate, however, It also contains many intermediate in molecular dynamics 
simulation, I do not understand the difference between relxation and molecular 
dynamics(cpmd) at all times. Anyone who would give suggestion will be appreciated.
    Thanks in advance
    Lihui Ou


Lihui Ou
PH.D Candidate in Electrochemistry                      
College of Chemistry and Molecular Science            
Wuhan University,430072,Hubei Province,China 
E-mail:oulihui666 at 126.com
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