A problem occurs during QST2 calculation-Any solution available?

I think our computational expertise is actually a bit low here, for something this advanced I would suggest posting on https://www.reddit.com/r/Chempros/

Good catch Corribus. I have manually changed his forum signature to not include his email. Only cached versions of this site should have it now.

Also, as a general rule, I'd avoid displaying your email address as you do at the end of your post. It's a great way to attract a lot of spam.

@wildfyr, Quote from:

I think our computational expertise is actually a bit low here, for something this advanced I would suggest posting on https://www.reddit.com/r/Chempros/

Thank you for concern and comments. I think, a 'Computational Chemistry' as a sub branch should be added in this forum. Please think on it. Of course, I shall gratefully accept your proposal to repost the problem in 'reddit.com'. Thanks a lot.

Keshab K. Adhikary