CCL: multi-reference CI
- From: "Shobe, David"
<dshobe+*+sud-chemieinc.com>
- Subject: CCL: multi-reference CI
- Date: Wed, 21 Sep 2005 17:55:35 -0400
Sent to CCL by: "Shobe, David" [dshobe+*+sud-chemieinc.com]
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GAMESS [both US and UK flavors] does multi-reference CI.
--David Shobe, Ph.D., M.L.S.
Süd-Chemie, Inc.
phone (502) 634-7409
fax (502) 634-7724
Don't bother flaming me: I'm behind a firewall.
-----Original Message-----
> From: owner-chemistry+*+ccl.net [mailto:owner-chemistry+*+ccl.net]
Sent: Wednesday, September 21, 2005 2:37 PM
To: Shobe, David
Subject: CCL: multi-reference CI
Sent to CCL by: jz7|-|duke.edu
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Dear all,
Which program can do the multi-reference CI calculation? I checked the most
popular Gaussian program. The manual only mentions the direct CI.
What other programs should I check?
Thanks a lot!
Jeny