Dear all PW usres..<br><br>I was dealing with the LIT(LiInTe2) system in chalcopyrite structure with <br>&SYSTEM<br> ibrav = 7,<br> celldm(1) = 9.854,<br> celldm(3) = 2,<br>
<br>and i was obtaning the volume after pw.x run as 956.8364 (a.u.)^3 which is the simply celldm(1)^3=(9.854)^3.<br>Here i wondered why i am not obtaning the volume as 2*(9.854)^3? Am i somewhere wrong in conceptual basis?<br>
<br>Thanks in advanced .<br clear="all"><br>-- <br>Thanks and Regards<br>Bramha Prasad Pandey<br>GLA University, Mathura.<br>INDIA.<br><br>