[Wien] LDA+U

Souraya GOUMRI-SAID goumri-said at univ-paris12.fr
Thu Aug 18 14:28:57 CEST 2005


Dear hem kandpa,


I know that evry thing is in the user guide, but sometimes it is not clear and
obvious to use it, this why the mailing list was created !!!.


I have run x orb after runing a scf cycle, but I have an error message :

ERROR IN OPENING UNIT: 5
        FILENAME: case.inorb                     STATUS: old         
FORM:formatted
STOP OPEN FAILED
0.0u 0.0s 0:00 0% 0+0k 0+0io 0pf+0w

Can someone help me to overcome this pb. 

regards,

souraya


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