Home › Forums › density functional theory › Hartree-Fock versus DFT › HF vs DFT This topic has 0 replies, 1 voice, and was last updated 2 days, 9 hours ago by Olivier N. Viewing 1 post (of 1 total) Author Posts October 10, 2025 at 4:09 pm #13545 Olivier NParticipant I believe the shown molecule is very complex. Since HF is computationally very expensive, I think DFT would provide a better fit for this kind of problem. 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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