[Q] SP with CBS-QB3 is possible?



Dear colleague,

According to the Gaussian98 manual, SP (single point) keyword can be applied to ALL method including complete basis set methods.
Now I'm trying to get a single point energy by the CBS-QB3, and write the route line as

#T CBS-QB3 SP

However, it found that it initaily geometry optimization process.
Isn't it possible to carry out single point energy calculation by CBS-QB3?

Thank you!

Hohjai Lee (hohjai_y - at - korea.ac.kr)

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Hohjai Lee

Nano&Environmental Science Lab.

503, Asan Science Hall, Dep't of Chemistry, Korea Univ.

5-1, Anam-dong, Sungbuk-gu, Seoul, 136-701 KOREA

Tel : (+82)-2-3290-3617, (+82)-2-3290-3550 FAX : (+82)-2-3290-3121

E-mail : hohjai_y - at - korea.ac.kr

Homepage : http://neslab.korea.ac.kr