How to spesify a B3LYP singular point energy calculation?

How to spesify a B3LYP singular point energy calculation?

From: Yong Wang (НхУА) <wangyong_at_email.domain.hidden>
Date: Sun, 30 Oct 2005 20:05:05 +0800
X-mailer: Foxmail 5.0 [cn]

Dear all ADFer,

I want to do a SP calculation with B3LYP hybrid DFT, could anyone kindly tell me how to spesify it in the input file?

just add following scripts?

metagga b3lyp
hfexchage

Any response will be greatly appreciated in advance!

Yours,
Yong
Received on 2005-10-30 13:03:36

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