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ROHF calculation with define
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Topic: ROHF calculation with define (Read 6014 times)
Morbert
Newbie
Posts: 1
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ROHF calculation with define
«
on:
June 16, 2010, 01:31:16 PM »
Hi,
Just wondering if it's possible to set up a ROHF calculation with define, as opposed to directly manipulating the control file.
Thanks
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christof.haettig
Global Moderator
Sr. Member
Posts: 291
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Re: ROHF calculation with define
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Reply #1 on:
July 20, 2010, 05:52:41 PM »
Of cause. That's the usual way to go. You can specify all required options in the MO menu.
Regards,
Christof
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Define
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ROHF calculation with define