Showing 1 - 20 results of 10,157 for search '(((( algorithm from function ) OR ( algorithm cost function ))) OR ( algorithm fc function ))', query time: 0.61s Refine Results
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    Efficient Algorithms for GPU Accelerated Evaluation of the DFT Exchange-Correlation Functional by Ryan Stocks (16867476)

    Published 2025
    “…We show that batched formation of the XC matrix from the density matrix yields the best performance for large (>O(103) basis functions), sparse systems such as glycine chains and water clusters. …”
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    DMTD algorithm. by Yunhu Huang (21402795)

    Published 2025
    “…On the basis of EITO<sub>E</sub>, we propose EITO<sub>P</sub> algorithm using the PPO algorithm to optimize multiple objectives by designing reinforcement learning strategies, rewards, and value functions. …”