[Wien] parallel calculation

Peter Blaha pblaha at theochem.tuwien.ac.at
Wed Sep 28 17:36:09 CEST 2005


In a terminal window prepare a case with .machines file and type:

x lapw1 -p               (what are the errors? If it does not work try

ssh host1 "cd path/casedir;lapw1 lapw1_1.def"            (or rsh)

does this work ?  (use the proper names for host1, path and casedir)



> Dear Wien users:
> 
> We encounted some problems with parallel calculation. We read the Guide and have set up remote login, both in ssh and rsh. In our personal account, we can login to each other without providing passwords, thorough public keys or .rhosots files in bash shell. But in Wien2k, we can not make remote connection, even if it is on the same host. Any body can help us solve this problems?
> 
> We use SuSE Linus Enterprise Server 9.0 (64 bits) as operation system, and PGI 5.1 as compiler.
> Wien2k version is Wien2k_05.
> 
> Many thanks in advance!
> 
> Yousong Gu


                                      P.Blaha
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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/
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