[Pw_forum] Parallel Running the Example 01 (Stop !!!!)

Ngoc Linh Nguyen nnlinh at sissa.it
Sat Feb 27 11:37:55 CET 2010


Masoud Nahali wrote:
> Dear Quantum Espresso Users
>  
> I have installed parallel Quantum Espresso successfully and tried to 
> run the exapmle 01.
> at first I tried to run the example 01 from the root but the program 
> did't run and then I went out of the root for running (this is the 
> proposed by the QE). the first problem solved by going out of the 
> root. Once I could run the example 01 but amazingly I cannot now !!. 
> when I run the exaplme 01 the program stopped at this line:
>  
> running the scf calculation for Si...        and did not continue
>  
> and any CPU's did not work and there is not any results.
> My system is AMD (3 cores) and LAM-MPI works well. but I think that 
> the problem is related to lam ! since at first time that I tried QE 
> aked me to boot the lam by lamboot and I do to continue. and it is so 
> interesting that I runned once and cleaned the temporary but again I 
> can not !!!
I suggest to use mpich-mpi. In the startup.f90 of QE , MPI commands are 
written agree with mpich-mpi.

Linh
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