[CPMD-list] (no subject)

[kdong]

Dear everyone,
   I am going to study my system using Ab initio molecular dynamics, now I can download the Quantum-espresso-3.2 and compile successfully on my computer. But I do not know the differences between Quantum-espresso-3.2 and CPMD-3.11, for example the properties of NMR, IR spectroscopy. 
 Who can tell me something about the  Quantum-espresso-3.2, and the differences of the two softwares in detail, and which is more appropiate to study the liquid system.
 yours sincerely
 K.Dong
 dongkun at home.ipe.a.cn


2007-10-31 



kdong 
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