Re: [Wien] error in x spaghetti for parallel computing

2016-02-17 Thread Dr. K. C. Bhamu
Dear Prof blaha and all my problem is now resolved. Thanks *Dr. K. C. Bhamu(UGC-Dr. D. S. Kothari Postdoc Fellow)Department of PhysicsGoa University, Goa-403 206IndiaMob. No. +91-9975238952* On Wed, Feb 17, 2016 at 1:45 PM, Dr. K. C. Bhamu

Re: [Wien] error in x spaghetti for parallel computing

2016-02-17 Thread Peter Blaha
When you do a parallel calculation you have to add-p to spaghetti x spaghetti -p - I guess the problem for lapw2 occurred when you resubmitted another batch job (without x lapw1 -p -band). This is clear, because only the lapw1 step creates suitable .machine*

Re: [Wien] error in x spaghetti for parallel computing

2016-02-17 Thread Dr. K. C. Bhamu
One more thing: When I checked the output file of x lapw2 -band then I got the following massage: running lapw2 in parallel mode calculating QTL's from parallel vectors ssh: connect to host nid01520 port: Connection refused^M lines are repeatitativelly written here for around 50times for

[Wien] error in x spaghetti for parallel computing

2016-02-17 Thread Dr. K. C. Bhamu
Dear Wien2k Prof Blaha and Gavin I ran my job on remote server using two nodes (64 cores). Everything went fine till" x lapw2 -p -band -qtl (checked with cat *.error). I inserted :FER into case.insp Then I ran x spaghetti and the following error occured: ERROR IN OPENING UNIT: 7