CCL:G: Query regarding strong correlation effect
- From: "Poonam Parkar"
<poonamparkar72\a/gmail.com>
- Subject: CCL:G: Query regarding strong correlation effect
- Date: Wed, 25 Jan 2023 00:17:33 -0500
Sent to CCL by: "Poonam Parkar" [poonamparkar72(-)gmail.com]
Dear All
I am Poonam Parkar, a Ph.D. student. I have been studying DFT and involved in
hydrogen storage.
What is strong correlation effect and how to study it for 3d elements using
Gaussian calculation. Which functional is suitable for this?
Please suggest me some solution.
Thank you in advance!!!