AMBER Archive (2009)

Subject: [AMBER] to understand multiplicity in antechamber

From: Alan (alanwilter_at_gmail.com)
Date: Fri Mar 13 2009 - 09:43:45 CDT


Hi there,
Could someone here point me to a more elaborated explanation of what
multiplicity means to antechamber and what this "(2S+1)" means?

Would 'S' stands for singlet: 0 unpaired electrons, double: 1 unpaired
electrons and so on?

Many thanks in advance.
Alan

-- 
Alan Wilter S. da Silva, D.Sc. - CCPN Research Associate
Department of Biochemistry, University of Cambridge.
80 Tennis Court Road, Cambridge CB2 1GA, UK.
>>http://www.bio.cam.ac.uk/~awd28<<
_______________________________________________
AMBER mailing list
AMBER_at_ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber