Re: [Wien] Cif2Struct again

2018-05-27 Thread William Lafargue-dit-Hauret 

Dear Sherif,

Just open your cif file using a Notepad or a terminal, and you will see 
more than one cell parameters and/or atomic coordinates are present, as 
Xavier said.


You can modify it by hand, but I recommend you to use a crystallographic 
software to generate it safely (Endavour for example).


Cheers,

William


Le 27/05/2018 à 22:49, Sherif Yehia a écrit :

Dear users  and expert

 I put question before on how to change cif to struct files   I got 
kindly  help  on changing cif to struct from


Xavier Rocquefelte 
 
Tue, 06 Mar 2018 
 



Your cif file contains 3 settings explaining why cif2struct cannot work.

unfortunately  I didn't   understand   what he did to change it to one 
setting   (my mistake)



I am attaching another one for YFe3

 Can I get some help with explanation on how to change .cif to struct  
to work right


Thank you in advance



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--
William LAFARGUE-DIT-HAURET
PhD Student
--
Institut des Sciences Chimiques de Rennes UMR 6226
Equipe Chimie Théorique Inorganique
Université de Rennes 1 - Campus de Beaulieu
35042 Rennes, France
Building 10B, Desk 211
Phone: +33 (0)2.23.23.57.91
Email: william.lafargue-dit-hau...@univ-rennes1.fr

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[Wien] Cif2Struct again

2018-05-27 Thread Sherif Yehia 
Dear users  and expert 

 I put question before on how to change cif to struct   files   I got kindly  
help  on changing cif to struct  from 

Xavier RocquefelteTue, 06 Mar 2018    
Your cif file contains 3 settings explaining why cif2struct cannot work.


unfortunately  I didn't   understand   what he did to change it to one setting  
 (my mistake) 


I am attaching another one for YFe3 

 Can I get some help with explanation on how to change .cif to struct  to work 
right 

Thank you in advance 
 
 

sm_isp_sd_0260504_download.cif
Description: application/vnd.multiad.creator.cif
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