From chemistry-request:~at~:www.ccl.net  Tue Aug 11 21:45:46 1998
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Subject: CCL:Valence DOS calculations
To: chemistry ":at:" www.ccl.net
Date: Wed, 12 Aug 1998 09:45:43 +0800 (SST)
From: "Chin Wee Shong" <chmcws%!at!%leonis.nus.edu.sg>
Cc: chmcws {*at*} leonis.nus.edu.sg (W S Chin)



Dear CCLers,

I am looking at ways/programmes to calculate the density of states
for some simple organic molecules in order to correlate that to their 
valence electronic structures.  Can someone please give your kind 
advice or pointers ?

Regards,
Lim S L
e-mail:scip4160  _-at-_) leonis.nus.edu.sg