[Wien] which file I can delete

Xavier Rocquefelte xavier.rocquefelte at univ-rennes1.fr
Mon Apr 25 07:39:40 CEST 2016


Dear Dr. Bhamu
you forget to put "-d" which explain why you did not restore from the 
files contained in the directory.
You must use the command

restore_lapw -d directory

More details, here:
http://100.36.165.205/usersguide/5_Shell_scripts.html#SECTION05222000000000000000

Regards
Xavier


Le 24/04/2016 22:25, Dr. K. C. Bhamu a écrit :
> Dear Prof Tran
>
> restore_lapw -f case did not restore the case.scf file in parent DIR. 
> In parent DIR I have only case.scf0, case.scf1 and so on but not 
> case.scf which was save in a DIR when I used save_lapw.
>
> any issue or I should copy it manually?
>
> regards
>
>
>
> ------------------------------------------------
> Dr. K. C. Bhamu
> (UGC-Dr. D. S. Kothari Postdoc Fellow)
> Department of Physics
> Goa University, Goa-403 206
> India
> Mob. No.  +91-9975238952
>
> On Sat, Apr 23, 2016 at 1:28 PM, <tran at theochem.tuwien.ac.at 
> <mailto:tran at theochem.tuwien.ac.at>> wrote:
>
>     Hi,
>
>     When a calculation is completed, it is recommended to use
>     save_lapw to save the important files (inputs, scf, clmsum)
>     under a new name. Since the vector file is not included in these
>     renamed files it should not be a problem to transfer them.
>
>     F. Tran
>
>     On Saturday 2016-04-23 09:10, Dr. K. C. Bhamu wrote:
>
>         Date: Sat, 23 Apr 2016 09:10:46
>         From: Dr. K. C. Bhamu <kcbhamu85 at gmail.com
>         <mailto:kcbhamu85 at gmail.com>>
>         Reply-To: A Mailing list for WIEN2k users
>         <wien at zeus.theochem.tuwien.ac.at
>         <mailto:wien at zeus.theochem.tuwien.ac.at>>
>         To: A Mailing list for WIEN2k users
>         <Wien at zeus.theochem.tuwien.ac.at
>         <mailto:Wien at zeus.theochem.tuwien.ac.at>>
>         Subject: [Wien] which file I can delete
>
>         Dear Wien2k users
>
>         I relaxed a structure and have couples of clmsum and vector
>         files which are very large and its very difficult to take them
>         from remote to local.
>         So please suggest is there any idea so that I can delete some
>         of these files (unnecessary large files) and by doing this I
>         can get files very easily from host.
>
>         Sincerely
>         Bhamu
>
>
>
>
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