set mixang option
Clicked A Few Times
12:36:48 PM PST - Thu, Mar 1st 2012
Dear developers,

is there documentation for the "set mixang" option? Which value of this option is appropriate (for example to obtain BS singlet)?

Forum Regular
7:41:58 AM PST - Fri, Mar 2nd 2012
Hi,

Check the following uploads for examples:

1) Using the "mixang" directive
http://nwchemgit.github.io/images/O3_singl.nw

2) Using the fragment guess option
http://nwchemgit.github.io/images/O3_af.nw

Best regards,
-Niri


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