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Report SCF (HF/DFT) Convergence Issues
Questions

Dear Q-Chem Community, If you have any SCF (HF/DFT) jobs that are time-consuming or are facing convergence difficulties with Q-Chem, please send them to support@q-chem.com with the subject line “SCF Convergence Issue” t…

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Use existing MOs without new SCF cycle
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Regarding Convergence in CDFT-CI
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0 64 October 25, 2024
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SCF convergence issue in NEO calculations
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