[Pw_forum] how to print G+k vectors file in ASCII format

[xirainbow]

Dear Andrea:
I follow your first suggestion and try "~espresso/bin/iotk convert  file.dat
 file.xml".
This method works smoothly.
And when I use "gedit" to open file.xml, I get data which are arranged in
columns and rows orderly.

However, when I tried to compile Test_QEXML, I failed.
1: I install QE-4.1.2 successfully.
2: I follow the README to change the QE directory in
makefile.(espresso_home=/home/raman/espresso-4.1.2)
3: I type "make all" in directory Test_QEXML. But  I got the following error
message:
@~/PWscf-accessory/Test_QEXML>make all
cd /home/raman/espresso-4.1.2/PP
make qexml.o
make[1]: Entering directory `/home/raman/PWscf-accessory/Test_QEXML'
make[1]: *** No rule to make target `qexml.o'.  Stop.
make[1]: Leaving directory `/home/raman/PWscf-accessory/Test_QEXML'
make: *** [/home/raman/espresso-4.1.2/PP/qexml.o] Error 2

I am not familiar with fortran. I use Fedora10.
Can you tell me how to deal with it?

Thanks in advance ：）

On Wed, Feb 10, 2010 at 9:55 PM, Andrea Ferretti <ferretti at mit.edu> wrote:

>
>
> Hi Xirainbow,
>
> "qexml_v3.1.1.f90", "qexml_v3.1.f90" are old versions of the library kept
> there for consistencies with previous versions of QE.
> Please refer to "~espresso/PP/qexml.f90", which must be the most up-to-date
> version of it. Note that back-compatibility with
> older versions of QE is supported.
>
> In terms of the usage of the library, you can have a look at a simple
> example at
>
> http://web.mit.edu/~ferretti/www/Test_QEXML.tgz
>
> instructions to compile, run and check the test are given inside the
> tarball.
>
> Developers: if you think that such an example can be useful to be
> discributed with the library, feel free to use it and include it.
>
> Andrea
>
>
-- 
____________________________________
Hui Wang
School of physics, Nankai University, Tianjin, China
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