Re: [Wien] which file I can delete

2016-04-25 Thread Dr. K. C. Bhamu
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

Re: [Wien] which file I can delete

2016-04-24 Thread Xavier Rocquefelte
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

Re: [Wien] which file I can delete

2016-04-24 Thread Stefaan Cottenier
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

Re: [Wien] which file I can delete

2016-04-24 Thread Gavin Abo
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

Re: [Wien] which file I can delete

2016-04-24 Thread Xavier Rocquefelte
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

Re: [Wien] which file I can delete

2016-04-24 Thread Dr. K. C. Bhamu
> 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

Re: [Wien] which file I can delete

2016-04-23 Thread Fecher, Gerhard
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

Re: [Wien] which file I can delete

2016-04-23 Thread Fecher, Gerhard
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

Re: [Wien] which file I can delete

2016-04-23 Thread Dr. K. C. Bhamu
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

Re: [Wien] which file I can delete

2016-04-23 Thread Fecher, Gerhard
[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

Re: [Wien] which file I can delete

2016-04-23 Thread tran
. 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

[Wien] which file I can delete

2016-04-23 Thread Dr. K. C. Bhamu
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