Dr. Laurence Marks,
Thanks a lot for your quick reply. I checked the mail readily but it
seems a
different problem, because I could run w2web and went through to `Struct-
Gen' and `initialize calc.' without any problem. I also ran
`./siteconfig' but
couldn't find `-O3' option.
Yeah it's the
Please see my comment there about how to find it:
http://zeus.theochem.tuwien.ac.at/pipermail/wien/2011-November/015688.html.
Maxim
28.11.2011 22:02, EGUCHI Gaku ?:
Dr. Laurence Marks,
Thanks a lot for your quick reply. I checked the mail readily but it
seems a
different problem,
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Dear Dr. Maxim Rakitin,
Thanks for your reply. But it seems that the download page was already
removed.
Best regards,
Gaku Eguchi
(11/11/29 4:08), Maxim Rakitin wrote:
Please see my comment there about how to find it:
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Wien at zeus.theochem.tuwien.ac.at
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Dear All,
Dr. Gavin Abo send me how to download the `Update3' from the Intel' website,
and I finally did it. Thanks for your help.
Best regards,
Gaku Eguchi
(11/11/29 14:40), EGUCHI Gaku wrote:
Dear Dr. Maxim Rakitin,
Thanks for your reply. But it seems that the download page was already
Yedukondalu
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Hi,
I'm not sure I understand exactly what you did.
Anyway: put R2V (instead of NR2V) in case.in0 and you get the coulomb potential
in a file case.vcoul (format as case.clmval), you can plot it using lapw5, or
you can have a look at the spherical symmetric part V_00(r).
Is this what you took in
Dear all,
I am running wien version 11.1 on a Dell Optiplex 755 running Fedora 12 (32bit),
fortran compiler ifort 12.1.0 and math libraries MKL 10.3.7.
The question concerns QTL, which I run in order to calculate some EELS spectra
for a larger structure. The calculation is done, for both the SCF
?
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