2a<br><br>
<div class="gmail_quote">On Fri, Apr 22, 2011 at 2:59 PM, Padmaja Patnaik <span dir="ltr"><<a href="mailto:padmaja_patnaik@yahoo.co.uk">padmaja_patnaik@yahoo.co.uk</a>></span> wrote:<br>
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<td valign="top">Hi all<br><br>I have a doubt regarding the value of celldm(1) in the input file for a supercell calculations. Celldm(1) is the lattice constant value. If I am using a supercell constructed by expanding the original lattice constant 'a' 2 times in all direction, then what will be the value of celldm(1) now? Will it be the original lattice constant 'a' or '2a'?<br>
<br>Thanks in advance<br>Regards<br><font color="#888888">Padmaja Patnaik<br>Research Scholar<br>Dept of Physics<br>IIT Bombay<br>Mumbai, India</font></td></tr></tbody></table><br>_______________________________________________<br>
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