Home › Forums › density functional theory › Hartree-Fock versus DFT › HF vs DFT This topic has 0 replies, 1 voice, and was last updated 2 months, 1 week ago by Klaas Luyckx. Viewing 1 post (of 1 total) Author Posts October 8, 2024 at 11:39 am #11555 Klaas LuyckxParticipant I would use DFT. The HF method would be computationally to expensive for a system of this many atoms 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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