[Pw_forum] phonon calculation of h2 molecule

Chaohao Hu chaohao2002 at 163.com
Fri Aug 19 02:58:53 CEST 2005


Dear Mr. Eyvaz,
Sorry,I modify "ATOMIC_POSITIONS" in my input file, the SCF
calculation runs very well. My Espresso program is serial,but
 I can not run it on a single PC CPU.
Can you provide me your input file? I will use it to test in my
PC.  
Thanks in advance.

Best regards,
Chaohao

============================================================
Dr.Ch.H.Hu
Institute of Metal Research,Chinese Academy of Sciences--IMR
Wenhua Road, 72
110016, Shenyang, Liaoning (China)
Phone: +086-024-23971641
Email: chhu at imr.ac.cn






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