Thank you all for nice explanation. I got the point.
Sincerely
Bhamu
On Mon, Apr 25, 2016 at 12:20 PM, Xavier Rocquefelte <
xavier.rocquefe...@univ-rennes1.fr> wrote:
> Indeed I never use the scf file when I restart a calculation.
> Have a nice week
> Xavier
>
> Le 25/04/2016 08:38, Stefaan Cot
Indeed I never use the scf file when I restart a calculation.
Have a nice week
Xavier
Le 25/04/2016 08:38, Stefaan Cottenier a écrit :
You must use the command
restore_lapw -d directory
Apparently, your computer works better than ours. I also don't see the
case.scf restored unless the scri
You must use the command
restore_lapw -d directory
Apparently, your computer works better than ours. I also don't see the
case.scf restored unless the script is modified:
The philosophy of restore_lapw is to be able to start a new calculation
based on the starting point of a previously sa
You must use the command
restore_lapw -d directory
Apparently, your computer works better than ours. I also don't see the
case.scf restored unless the script is modified:
username@computername:~/wiendata/TiC$ cat $WIENROOT/VERSION
WIEN2k_14.2 (Release 15/10/2014)
username@computername:~/w
Wien@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 ple
> From: Dr. K. C. Bhamu
>> Reply-To: A Mailing list for WIEN2k users <
>> wien@zeus.theochem.tuwien.ac.at>
>> To: A Mailing list for WIEN2k users
>> Subject: [Wien] which file I can delete
>>
>> Dear Wien2k users
>>
>> I relaxed a structure and hav
at>>
>To: A Mailing list for WIEN2k users
>mailto:Wien@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 ta
87 Dresden
Von: wien-boun...@zeus.theochem.tuwien.ac.at
[wien-boun...@zeus.theochem.tuwien.ac.at] im Auftrag von Dr. K. C. Bhamu
[kcbham...@gmail.com]
Gesendet: Samstag, 23. April 2016 11:57
An: A Mailing list for WIEN2k users
Betreff: Re: [Wien] which file I can delete
eochem.tuwien.ac.at [
> wien-boun...@zeus.theochem.tuwien.ac.at] im Auftrag von
> t...@theochem.tuwien.ac.at [t...@theochem.tuwien.ac.at]
> Gesendet: Samstag, 23. April 2016 09:58
> An: A Mailing list for WIEN2k users
> Betreff: Re: [Wien] which file I can delete
>
> Hi,
>
> When a c
[wien-boun...@zeus.theochem.tuwien.ac.at] im Auftrag von
t...@theochem.tuwien.ac.at [t...@theochem.tuwien.ac.at]
Gesendet: Samstag, 23. April 2016 09:58
An: A Mailing list for WIEN2k users
Betreff: Re: [Wien] which file I can delete
Hi,
When a calculation is completed, it is recommended to use
save_lapw to save the impor
. Bhamu wrote:
Date: Sat, 23 Apr 2016 09:10:46
From: Dr. K. C. Bhamu
Reply-To: A Mailing list for WIEN2k users
To: A Mailing list for WIEN2k users
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
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 fil
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