Showing 61 - 80 results of 3,022 for search '(((( algorithm basis function ) OR ( algorithm 8217 function ))) OR ( algorithm python function ))', query time: 0.60s 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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    Speed limits. by Yunhu Huang (21402795)

    Published 2025
    Subjects:
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