[Wien] Help to resolve the problem

Dr. Dinesh C. Gupta dcgupta at jiwaji.edu
Sat Nov 3 15:07:22 CET 2012





	Dear Sir :

	

	

	I need your help in resolving the problem faced during optimization as

	follows :

	

	

	Commandline: ./optimize.job

	

	Program input is: ""

	

	DSTART ENDS

	

	5.140u 0.014s 0:10.28 50.0%     0+0k 0+376io 0pf+0w

	

	DSTART ENDS

	

	5.080u 0.012s 0:10.48 48.5%     0+0k 0+376io 0pf+0w

	

	DSTART ENDS

	

	6.893u 0.014s 0:13.82 49.9%     0+0k 0+368io 0pf+0w

	

	DSTART ENDS

	

	6.866u 0.010s 0:13.80 49.7%     0+0k 0+152io 0pf+0w

	

	DSTART ENDS

	

	6.864u 0.013s 0:13.70 50.1%     0+0k 0+368io 0pf+0w

	

	0.015u 0.010s 0:00.00 0.0%      0+0k 0+336io 0pf+0w

	

	clmextrapol_lapw has generated a new CrN.clmsum

	

	DSTART ENDS

	

	6.895u 0.011s 0:13.80 50.0%     0+0k 0+368io 0pf+0w

	

	0.023u 0.004s 0:00.00 0.0%      0+0k 0+336io 0pf+0w

	

	clmextrapol_lapw has generated a new CrN.clmup

	

	DSTART ENDS

	

	6.890u 0.012s 0:06.86 100.5%    0+0k 0+360io 0pf+0w

	

	0.022u 0.005s 0:00.01 200.0%    0+0k 0+336io 0pf+0w

	

	clmextrapol_lapw has generated a new CrN.clmdn

	

	 LAPW0 END

	

	LAPW1 - Error

	

	

	

	>   stop error

	

	ERROR status in CrN_vol_-20.0

	

	

	

	Continue with

	

	

	

	

	

	Following is the reported error in error file lapw1.error

	

	

	

	'INILPW' - can't open unit: 18

	

	 'INILPW' -        filename:
CrN.vsp

	

	 'INILPW' -        
 status: old

	         form: formatted

	

	 'LAPW1' - INILPW aborted unsuccessfully.

	

	

	Kindly help me,

	

	Thanks,

	

	DCG

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