<html><body><div style="color:#000; background-color:#fff; font-family:HelveticaNeue, Helvetica Neue, Helvetica, Arial, Lucida Grande, sans-serif;font-size:12pt"><div>Respected Community Members, <br><br>I would be thankful if someone confirms the Format of the position of the atoms. We generated the structure file for a spinel compound ZnAl2O4 by selecting the space group No Fd-3m #227, chosing cubic lattice constant and angles, Selecting positions Zn(0.125,0.125,0.125), Al (0.5,0.5,0.5), O (0.2534,0.2534,0.2534). In return we got the Positions for 14 atoms in the primitive unit cell as mentioned below. Kindly confirm what is the formatt of input positions Zn(0.125,0.125,0.125), Al (0.5,0.5,0.5), O (0.2534,0.2534,0.2534) and other generated positions in the Structure file.<br><br>Zn 1: X=0.12500000 Y=0.12500000 Z=0.12500000<br> 2: X=0.87500000 Y=0.87500000 Z=0.87500000<br><br>Al 1:
X=0.50000000 Y=0.50000000 Z=0.50000000 <br> 3: X=0.50000000 Y=0.75000000 Z=0.75000000<br> 3: X=0.75000000 Y=0.75000000 Z=0.50000000<br> 4: X=0.75000000 Y=0.50000000 Z=0.75000000<br><br>O 1: X=0.25340000 Y=0.25340000 Z=0.25340000 <br> 2: X=0.74660000 Y=0.74660000 Z=0.74660000<br> 3: X=0.74660000 Y=0.50340000 Z=0.50340000<br> 4: X=0.25340000 Y=0.99660000 Z=0.99660000<br> 5: X=0.99660000 Y=0.99660000 Z=0.25340000<br> <br></div><div><br></div><div>Best wishes<br>Masood<br>Universiti Tecknologi Malaysia<br></div></div></body></html>