Home › Forums › density functional theory › Hartree-Fock versus DFT › HF vs DFT This topic has 0 replies, 1 voice, and was last updated 2 years ago by Tristan Boen. Viewing 1 post (of 1 total) Author Posts October 9, 2022 at 9:13 am #7020 Tristan BoenParticipant You would use DFT as the correlations are very important in this molecule, as there are a lot of them. Author Posts Viewing 1 post (of 1 total) You must be logged in to reply to this topic. Log In Username: Password: Keep me signed in Log In
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