From owner-chemistry@ccl.net Thu Apr 4 19:26:00 2013 From: "typ2469 typ2469 _ 126.com" To: CCL Subject: CCL:G: How to calculate the charge and multisiplity of Gaussian 98 Message-Id: <-48524-130404190925-2852-e0dkKMl+ExTyvKsMyPWlXQ-.-server.ccl.net> X-Original-From: typ2469 Content-Type: multipart/alternative; boundary="----=_Part_4200_1584861098.1365116948918" Date: Fri, 5 Apr 2013 07:09:08 +0800 (CST) MIME-Version: 1.0 Sent to CCL by: typ2469 [typ2469/./126.com] ------=_Part_4200_1584861098.1365116948918 Content-Type: text/plain; charset=GBK Content-Transfer-Encoding: 7bit Hi The charge and Multiplicity are -2 and 1 for [SO4]2- anion, and my question is: when the calcalated system have two [SO4]2- anions, what are the Charge and Multiplicity for the two anions system for Gaussian calculation? Thank you very much! Best wishes Dr. Yi-Ping Tong ------=_Part_4200_1584861098.1365116948918 Content-Type: text/html; charset=GBK Content-Transfer-Encoding: 7bit
Hi
The charge and Multiplicity are  -2 and 1 for [SO4]2-  anion, and my question is: when the calcalated system have two [SO4]2- anions,  what are the Charge and Multiplicity for the two anions system for Gaussian calculation?  Thank you very much!
 
Best wishes
 
Dr. Yi-Ping Tong 


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