Home › Forums › density functional theory › Hartree-Fock versus DFT › HF and DFT This topic has 0 replies, 1 voice, and was last updated 3 months ago by chuannan. Viewing 1 post (of 1 total) Author Posts September 11, 2024 at 6:36 am #11133 chuannanParticipant For this molecule, I will use the DFT, since it’s efficiency. While Hatree-fork method is accuracy, but for large system, it’s time consuming. 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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