Posted by Philips Kumar Rai on August 06, 2021 at 06:47:01:
In Reply to: Re: CASPT2 convergence problem posted by Steven Vancoillie on September 18, 2015 at 08:25:36:
: I will contact you by email so we can have a closer look.
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Subject:
if B is 1s22s22p1, what is Li?
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Comments: : : I will contact you by email so we can have a closer look.