[gpaw-users] Bader analysis

[Vladislav Ivanistsev]

I've tried both 'bader' and 'sh bader' commands on Linux (64bit), Windows
and Mac. On linux, the first returns: "bader: command not found", the
second - 'bader: 4: Syntax error: word unexpected (expecting ")")'. Similar
on Win and Mac.

) don't know if i have any shell wrapper

On Tue, May 22, 2012 at 11:00 AM, Marcin Dulak <Marcin.Dulak at fysik.dtu.dk>wrote:

>  Hi,
>
> `bader` is available from http://theory.cm.utexas.edu/bader/ as a
> compiled executable (
> http://theory.cm.utexas.edu/bader/download/bader_lnx_64.tar.gz),
> i think only for 64-bit machines. Is it a kind of shell wrapper that you
> are executing?
>
> Marcin
>
>
> On 05/22/12 16:31, Vladislav Ivanistsev wrote:
>
> Dear all,
>
>  Often I have an error executing as "sh bader": bader: 4: Syntax error:
> word unexpected (expecting ")")
>
>  or 'bader: 1: Syntax error: "(" unexpected', when compiled from source.
>
>  I do remember, that at some machines the same bader worked, while at
> others id didn't. Does anyone know what could be the reason and how to fix
> this behavior?
>
>  Regards,
> Vladislav
>
> On Fri, Jan 6, 2012 at 6:58 AM, Marcin Dulak <Marcin.Dulak at fysik.dtu.dk>wrote:
>
>> Hi,
>>
>> i think it's because you need also the bader executable (
>> http://theory.cm.utexas.edu/bader/)
>>
>> Best regards,
>>
>> Marcin
>>
>>
>> Vladislav Ivanistsev wrote:
>>
>>> With ASE and GPAW installed on ubuntu 11.04 followed the tutorial:
>>> https://wiki.fysik.dtu.dk/ase/ase/dft/bader.html, and got 'bader:
>>> command not found'. Some time ago I did Bader analysis, but the command
>>> does not work in this time. Does someone has a notion, why?
>>> Gratefully,
>>> Vladislav Ivanistsev
>>> University of Tartu
>>>
>>
>>
>>
>
>
> --
> ***********************************
>
> Marcin Dulak
> Technical University of Denmark
> Department of Physics
> Building 307, Room 229
> DK-2800 Kongens Lyngby
> Denmark
> Tel.: (+45) 4525 3157
> Fax.: (+45) 4593 2399
> email: Marcin.Dulak at fysik.dtu.dk
>
> ***********************************
>
>
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