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    The Effective Fragment Molecular Orbital Method: Achieving High Scalability and Accuracy for Large Systems by Tosaporn Sattasathuchana (3377324)

    Published 2024
    “…It is demonstrated that excellent accuracy (<1 kcal/mol error per fragment) can be achieved when using a sufficiently large basis set with diffuse functions coupled with a small <i>R</i><sub>cut</sub> value. …”
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