[Wien] runsp_lapw -p (LAPW1 crashed!)

[Jorissen Kevin]

Can you run the remote job by hand?  I.e., does
ssh srnd17 "cd [your directory] ;$WIENROOT/lapw1 lapw1_1.def" &
work?  (replace ssh by rsh if necessary, lapw1 by lapw1c ...) (to speed up the test, you might go into case.klist_1 and reduce it to just one k-point).
 
If this works, then it's the lapw1para script that probably causes problems  (also if you don't have lapw1_1.def and case.klist_1).  If this doesn't work, something in the setup of your system may cause problems (are the WIENROOT directory and your working directory accessible under the same name, is the ssh/rsh configured correctly ...).
 
Kevin.
 

	-----Oorspronkelijk bericht----- 
	Van: ccmp at nju.edu.cn [mailto:ccmp at nju.edu.cn] 
	Verzonden: vr 6/25/2004 1:13 
	Aan: wien at zeus.theochem.tuwien.ac.at 
	CC: 
	Onderwerp: [Wien] runsp_lapw -p (LAPW1 crashed!)
	
	

	Dear WIEN2K users and developers
	
	I am running the wien2k_03 at SR11000 machine of Hitachi.
	
	For runsp_lapw, everything is OK.
	
	But when I try to use the k-point parallelization, the lapw1 crashed.
	
	Following is the case.dayfile:
	
	---------------------------
	    start       (Fri Jun 25 19:19:41 JST 2004) with lapw0 (20/20 to go)
	>   lapw0 -p    (19:19:41) starting parallel lapw0 at Fri Jun 25 19:19:41 JST 2004
	--------
	running lapw0 in single mode
	23.0u 0.2s 0:23 99% 1568+47233k 0+0io 0pf+0w
	>   lapw1  -up -p       (19:20:04) starting parallel lapw1 at Fri Jun 25 19:20:04 JST 2004
	->  starting parallel LAPW1 jobs at Fri Jun 25 19:20:04 JST 2004
	running LAPW1 in parallel mode (using .machines)
	2 number_of_parallel_jobs
	**  LAPW1 crashed!
	0.0u 0.2s 0:04 6% 71+71k 0+0io 0pf+0w
	
	>   stop error
	-------------------------------
	
	
	
	My .machine is:
	
	-------------------------------
	granularity:1
	1:srnd17
	1:srnd17
	-------------------------------
	
	
	I had check the lapw1para file very carefully, and find that the problem is at the "kloop" region of lapw1para file. But the "kloop" region of lapw1para is rather long. I cannot locate the position of problem. Who can help me?
	
	
	With all my best wish!
	
	Xiangang
	
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