[Wien] About the machines file for mpi

[liyh]

Dear Blaha,
   
       Do you means if I have two k-points the machines file should like this?
#For lapw0_mpi
lapw0: comp124 comp123
#For lapw1_mpi/lapw2_mpi
1:comp124 comp123
2:comp124 comp123
Does it correct?
I have looked the UG, it is very simple and only give the example for k-points parrel, but not for mpi.

Yonghua

>Please have a look at page 61 in the UG. 
>
>The lapw0 line must be a single line like
>
>lapw0:comp124 comp123 comp80 ...
>
>For lapw1 AND lapw2 again for each k-point you must use a single line only 
>like:
>
>1:comp124 comp123 comp80 ...
>
>
>
>>       I want to run wien2k in parallel using mpi method. But I dont know how to creat the .machines file. This is part of our script file for pbs submitting.
>> ...........
>> this is the created .machines file by this script.
>> 
>> lapw0:comp124
>> comp123
>> comp80
>> comp120
>> comp69
>> comp127
>> lapw1:comp124
>> comp123
>> comp80
>> comp120
>> comp69
>> comp127
>> lapw2:comp124
>> comp123
>> comp80
>> comp120
>> comp69
>> comp127
>> 
>> Does it correct? Could you give me some sugest?
>> 
>> Best Wish to You!
>> 
>> Yonghua
>> 
>> _______________________________________________
>> Wien mailing list
>> Wien at zeus.theochem.tuwien.ac.at
>> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
>> 
>
>
>                                      P.Blaha
>--------------------------------------------------------------------------
>Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
>Phone: +43-1-58801-15671             FAX: +43-1-58801-15698
>Email: blaha at theochem.tuwien.ac.at    WWW: http://info.tuwien.ac.at/theochem/
>--------------------------------------------------------------------------
>
>_______________________________________________
>Wien mailing list
>Wien at zeus.theochem.tuwien.ac.at
>http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien

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　　　　　　　　致
礼！
 
				 
　　　　　　　　liyh
　　　　　　　　lyhua at fudan.edu.cn
　　　　　　　　　　2005-01-22