Showing 121 - 140 results of 1,035 for search '(((( algorithm cep function ) OR ( algorithms basis function ))) OR ( algorithm python function ))', query time: 0.64s Refine Results
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    Linear-Scaling Local Natural Orbital CCSD(T) Approach for Open-Shell Systems: Algorithms, Benchmarks, and Large-Scale Applications by P. Bernát Szabó (10526316)

    Published 2023
    “…This enables the accurate modeling of large systems with complex electronic structures, as illustrated on open-shell organic radicals and transition-metal complexes of up to 179 atoms as well as on challenging biochemical systems, including up to 601 atoms and 11,000 basis functions. While the protein models involve difficulties for local approximations, such as the spin states of a bounded iron ion or an extremely delocalized singly occupied orbital, the corresponding single-node LNO-CCSD­(T) computations were feasible in a matter of days with 10s to 100 GB of memory use. …”
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    Explained variance ration of the PCA algorithm. by Abeer Aljohani (18497914)

    Published 2025
    “…<div><p>Chest X-ray image classification plays an important role in medical diagnostics. Machine learning algorithms enhanced the performance of these classification algorithms by introducing advance techniques. …”
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    Raw data. by Honglei Pang (22693724)

    Published 2025
    Subjects:
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    Code program. by Honglei Pang (22693724)

    Published 2025
    Subjects:
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