Showing 1 - 20 results of 19,396 for search '(((( algorithm _ function ) OR ( algorithm basis function ))) OR ( algorithm both function ))*', query time: 0.70s Refine Results
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    Efficient Algorithms for GPU Accelerated Evaluation of the DFT Exchange-Correlation Functional by Ryan Stocks (16867476)

    Published 2025
    “…In this work, we present a comparative study of four GPU-accelerated algorithms for evaluating the KS-DFT exchange–correlation (XC) potential with an atom-centered Gaussian basis. …”
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    Performance profiles of these algorithms on the basis of the number of function evaluations. by Xianfeng Ding (535904)

    Published 2021
    “…<p>Performance profiles of these algorithms on the basis of the number of function evaluations.…”
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    The schematic view of the Radial Basis Function (RBF) algorithm. by Mohsen Yoosefzadeh-Najafabadi (6917399)

    Published 2021
    “…<p>The schematic view of the Radial Basis Function (RBF) algorithm.</p>…”
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    EFGs: A Complete and Accurate Implementation of Ertl’s Functional Group Detection Algorithm in RDKit by Gonzalo Colmenarejo (650249)

    Published 2025
    “…Ertl’s algorithm is an approach to extract functional groups in arbitrary organic molecules that does not depend on predefined libraries of functional groups. …”
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    Convergence curves of various algorithms under test functions. by Jiayuan Wang (3765376)

    Published 2025
    “…<p>Convergence curves of various algorithms under test functions.</p>…”
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    Convergence curves of various algorithms under test functions. by Jiayuan Wang (3765376)

    Published 2025
    “…<p>Convergence curves of various algorithms under test functions.</p>…”
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    The convergence curve of each optimization algorithm under the test function. by Hao Yang (328526)

    Published 2025
    “…<p>The convergence curve of each optimization algorithm under the test function.</p>…”
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