[Cod-bugs] bug feedback

Antanas Vaitkus antanas.vaitkus90 at gmail.com
Thu Jun 21 14:06:08 EEST 2018


Dear Xiaoyang Jiao,

thank You for Your bug report. My comments on the issues are written below.

2018-06-20 9:07 GMT+03:00 Xiaoyang Jiao <nature123.jiaoxiaoyang at gmail.com>:

> http://qiserver.ugr.es/cod/index.php
> bug
>
> 19
> card No. 2104744  2104755
> The mineral name and JSmol is Fluorapatite, but the reference is
> pyrrhotite.
>

In this case the reference does not seem to be a  bug, since the crystal
structure was published alongside
the publication about pyrhotite (doi: 10.1107/S0108768110011845). Please
correct me if I misunderstood
Your comment.


> 20
> card No. 1539007
> The Chemical name "MnRb" should be 'MnRh'
>

That was indeed a mistake and I have corrected it.


> 21
> card No. 8104339
> The lattice data do not match the reference.
> The correct should be a=5.917, b=4.758, c=6.441, β=116.34°
>

This seems to have been a much deeper issue. but I have corrected it.
The space group, lattice parameters and the atomic coordinates have been
changed due to the structure being originally uploaded in a different space
group setting than the one described in the original publication ("-P 2ybc"
instead of "-P 2yn"). Some additional pieces of information like the R
factor
and the anisotropic parameter values have also been added.


>
> -------------------------------------------------------
>
> http://crystallography-online.com/
>
> bug
>
> 01. The page button is invalid under the browsher of firefox (ver. 51.0),
> windows XP.
>
> 20180620
>
> The crystallograpy-online.com website is not an official COD mirror. It
is run by
Dr. Volodymyr Vreshch. You should probably relay these error messages to him
(i.e. crystallography.online at gmail.com).



> _______________________________________________
> Cod-bugs mailing list
> Cod-bugs at lists.crystallography.net
> http://lists.crystallography.net/cgi-bin/mailman/listinfo/cod-bugs
>
>
Sincerely,
Antanas Vaitkus

-- 
Antanas Vaitkus,
PhD student at Vilnius University Institute of Biotechnology,
room V325, Saulėtekio al. 7,
LT-10257 Vilnius, Lithuania
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