Re: [Wien] About mailing list

2016-11-18 Thread Fecher, Gerhard
There are things known and things unknown and in between are the doors.
Jim Morrison, 1943 - 1971

Sorry, but I did never understood why there are questions possible where the 
answer is known before the question is asked
Now I understand, it is just the repetition of a repetition.

Ciao
Gerhard

DEEP THOUGHT in D. Adams; Hitchhikers Guide to the Galaxy:
"I think the problem, to be quite honest with you,
is that you have never actually known what the question is."


Dr. Gerhard H. Fecher
Institut of Inorganic and Analytical Chemistry
Johannes Gutenberg - University
55099 Mainz
and
Max Planck Institute for Chemical Physics of Solids
01187 Dresden

Von: Wien [wien-boun...@zeus.theochem.tuwien.ac.at] im Auftrag von amina flower 
[sujuf...@live.fr]
Gesendet: Freitag, 18. November 2016 19:35
An: wien@zeus.theochem.tuwien.ac.at
Betreff: [Wien] About mailing list

Hello I an a new subscriber, if I have any question where and how should I post 
it.


Best regards.

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[Wien] vec2old_lapw

2016-11-18 Thread Martin Kroeker
You will probably find the "vec2old_lapw" executable (or rather, shell script) 
in the same directory
as lapw2 etc. - what is special about it, is that it is one of a handful of 
tools that relies on 
/bin/tcsh to run it, while most use /bin/csh (on "most" linux systems, /bin/csh 
will be just a link to
/bin/tcsh, but it could be that you have the original csh installed rather than 
its successor tcsh)
-- 
Dr. Martin Kroekermar...@ruby.chemie.uni-freiburg.de
c/o Prof.Dr. Caroline Roehr
Institut fuer Anorganische und Analytische Chemie der Universitaet Freiburg

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[Wien] About mailing list

2016-11-18 Thread amina flower
Hello, I am a new subscriber to the mailing list of Wien2k, where should I post 
my question if I have any ?


Best regards.
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[Wien] About mailing list

2016-11-18 Thread amina flower
Hello I an a new subscriber, if I have any question where and how should I post 
it.


Best regards.
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[Wien] Problem with k-vectors in "filename. spaghetti_ene"

2016-11-18 Thread Hosein Khani
The first three columns of "filename.spaghetti_ene" seem to represent
the (kx,ky,kz) in the chosen path (by xcrysden) for band plot.However,
they don't give the expected results. For example for a hexagonal
structure, like MoS2,the angle Gamma-M-K is not 90 deg. Also Gamma-M
is not equal to half of the reciprocal lattice vector a*. We
appreciate any help.

Best Regard
Hosein
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Re: [Wien] regarding permission of Wien2k commands

2016-11-18 Thread Elias Assmann
Dear Bhamu,

I fail to understand the problem.

On 11/17/2016 08:33 AM, Dr. K. C. Bhamu wrote:
> While playing with unix commands on my machine, I lost permission of all
> Wien2k commands. Because of this I am not able to run any Wien2k commands.
> 
> I am getting the following permissions for all commands:
> 
> -rwxrwxr-x" .

That combination of statements does not make sense.  If you see the
permissions you state, you have permission to “execute” that file (and
so does every other user since the “a+x” bit is set).

> How to get rid off this problem?

If the problem is that you cannot run the commands, the reason is
somewhere else.  Post the error you are seeing.

If the problem is that you set executable permissions on every file and
want to reverse that, that is harder since you have to figure out which
files “should” have that permission.


Elias





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Re: [Wien] [not solved] regarding permission of Wien2k commands

2016-11-18 Thread Lyudmila Dobysheva

17.11.2016 21:35, Dr. K. C. Bhamu wrote:

I ran the chmod -R ugo+r,a+X *   command in the Wien2k dir and the
problem is still same:
  -rwxrwxr-x for all files.
On Thu, Nov 17, 2016 at 01:03:48PM +0530, Dr. K. C. Bhamu wrote:
 > I am getting the following permissions for all commands:
 > -rwxrwxr-x"


I have already wrote you that you have correct permissions!
-rwxrwxr-x:
- means it is a file (not directory)
rwx the owner (you) has rights to read, write, execute
rwx the group -"-
r-x others have rights to read and execute, not to write

So, again: what is your problem?

  Lyudmila Dobysheva
--
Phys.-Techn. Institute of Ural Br. of Russian Ac. of Sci.
426001 Izhevsk, ul.Kirova 132
RUSSIA
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http://ftiudm.ru/content/view/25/103/lang,english/
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