[Wien] regarding structure change
mandeep hooda
mandeep103 at gmail.com
Fri Aug 28 15:14:05 CEST 2015
Thanks Sir for help. I am writing this mail in reference to my previous
mail SUBJECT " regarding symmetry change." In w2web i have not selected
xcrysden. I have clicked on "createZrTe3.klist_band where it is already
showing simple cubic and there is no option of monoclinic structure.
Initially when I solved some other structures I got as I expected. But now
it shows simple cubic for tetragonal as well as monoclinic structure. I
have attached html picture of ZrTe3. I have followed the steps shown in
this , nothing more. I hope you will get the point where I have made
mistake. I am really thankful for your help.
Thanks and Regards
Mandeep Kumar
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