[Wien] (no subject)

Ritabrata Bhowmick ritabrata at rcais.org.in
Mon Mar 27 06:06:57 CEST 2006


Dear Gerhard,
I tried to figure that out. I can see that volume V=2 x (a/2)^3. My 
cell is FCC. But why this relation?
I look forward to your help once more.
Thank you,
Ritabrata

What cubic system are you talking about, simple, face centered or body 
centered ?
Maybe this answers already youre question.


-----Ursprüngliche Nachricht-----
Von: wien-bounces at zeus.theochem.tuwien.ac.at im Auftrag von Your Name
Gesendet: Fr 24.03.2006 05:06
An: wien at zeus.theochem.tuwien.ac.at
Betreff: [Wien] cell volume

Hello all users,
I am a newbie and have a simple question. Why is the unit cell volume 
of a cubic cell (as seen in the scf file)not equal to a^3 (cube of 
lattice length). What volume is derived in the scf file?
Thank you in advance
Ritabrata 
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