should do also
another criteria like the options 3 and/or 4?
thanks
sufyan naji
-- next part --
An HTML attachment was scrubbed...
URL:
http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20120320/a5ee0a14/attachment.htm
should do also
another criteria like the options 3 and/or 4?
thanks
sufyan naji
-- next part --
An HTML attachment was scrubbed...
URL:
http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20120319/daa46ce4/attachment.htm
Dear P.Blaha and Wien2k Users,
I have a question: Does the volume optimization have un effect on the
magnetic configuration (ferromagnetis or antiferromagnetism) and also the
opposite of that ?
thanks
sufyan naji
-- next part --
An HTML attachment was scrubbed...
URL
*
***
** **
** **
** **
--
*From:* wien-bounces at zeus.theochem.tuwien.ac.at [mailto:
wien-bounces at zeus.theochem.tuwien.ac.at] *On Behalf Of *sufyan
*Sent:* Friday, February 17, 2012 11:14 PM
*To:* A** **Mailing list** **for** **WIEN2k** **users
*Subject:* [**Wien
] *On Behalf Of *sufyan
*Sent:* Friday, February 17, 2012 11:14 PM
*To:* A** **Mailing list** **for** **WIEN2k** **users
*Subject:* [**Wien**] L2main - QTL-B Error with spin-orbit caluclation***
*
** **
Dears developers and users,
I did my calculation for my case peroveskite
of (3d atom) , the calculation has
done very well up to (( run[sp]_lapw , save_lapw case_nrel , initso_lapw )
but I have this problem when i run runsp_lapw -so :
LAPW0 END
LAPW1 END
LAPW1 END
LAPWSO END
L2main - QTL-B Error
stop error
Thank you for helps.
Sincerely,
sufyan Naji
Dears developers and users,
I have a question if i can continue the calculation starting from the last
SCF: cycle ,after it stopped a cause of external reason
Thank you for helps.
Sincerely,
sufyan Naji
-- next part --
An HTML attachment was scrubbed...
URL
: aflamno3-2.vsp
'LAPW2' - status: old form: forma
i need any suggestions for treat this problem
thanks
sufyan naji
-- next part --
An HTML attachment was scrubbed...
URL:
http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20120121/b1c0ae86
libmkl_vml_p4n.so
libmkl_gf_ilp64.a libmkl_pgi_thread.a locale
thanks
sufyan naji
-- next part --
An HTML attachment was scrubbed...
URL:
http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20111227/bda821fa/attachment.htm
-2b9e9c00 ---p 00:00 0
7fff26671000-7fff26688000 rw-p 00:00 0
[stack]
7fff267e2000-7fff267e3000 r-xp 00:00 0
[vdso]
ff60-ff601000 r-xp 00:00 0
[vsyscall]
stop error
thanks
sufyan naji
-- next part --
An HTML
uplapw1.def failed
stop error
Thank you for helps.
Sincerely,
sufyan Naji
-- next part --
An HTML attachment was scrubbed...
URL:
http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/2010/69ca4c0e/attachment.htm
.2 (0x2b4cad39d000)
but i do not find the problem??
thanks for your helps
sufyan naji
2011/11/10 Laurence Marks L-marks at northwestern.edu
For something like this it is ALWAYS a good idea to put the error into
a google search, e.g. search on
MKL FATAL ERROR on load the function
Dears users,
i am new user in wien2k community and i need your help
i run my case ZnO with the version 11.1 but LAWP1 runs i have these errors
Error in PAIRHESS and Error in LAPW1
Thank you for helps.
Sincerely,
sufyan Naji
-- next part --
An HTML attachment
Dear prof Blaha , Dear Wien2k users
I have a problem and i need your help
when i use Wien2k-11 with the exaple of TiC in userguid
i have this*runsp_lapw -ec 0.0001 -cc 0.0001 -NI
*
thanks
-- next part --
An HTML attachment was scrubbed...
URL:
Dear prof Blaha , Dear Wien2k users
I have a problem with the installation and i need your help
i have thismake: *** No rule to make target `complex'. Stop.*
*in compil.msg in the folder SCRSRC_lapw0
This is error or no
thanks
-- next part --
An HTML attachment
Dear prof Blaha , Dear Wien2k users
I have a problem with the instalition of w2web and i need your help
first:i have this*make: *** No rule to make target `clean'. Stop.
make: *** No targets. Stop *in compil.msg in the folder SCR_w2web
and
sufyan2020 at sufyan:~/WIEN2k
Dear users,
I have a problem with the instalition of w2web and i need your help
sufyan2020 at sufyan:~/WIEN2k/SRC_w2web/bin$ ./w2web
w2web failed to bind port 7890 - port already in use!
You may want to try w2web -p portnumber
sufyan2020 at sufyan:~/WIEN2k/SRC_w2web/bin$ ./w2web -p 8890
w2web
17 matches
Mail list logo