Showing 101 - 120 results of 12,609 for search '(((( algorithm i function ) OR ( algorithms basis function ))) OR ( algorithm python function ))', query time: 1.28s Refine Results
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    Data_Sheet_1_Parallel Implementation of Large-Scale Linear Scaling Density Functional Theory Calculations With Numerical Atomic Orbitals in HONPAS.PDF by Zhaolong Luo (9692087)

    Published 2020
    “…Such a linear-scaling density matrix purification algorithm is based on the Kohn's nearsightedness principle, resulting in a sparse Hamiltonian matrix with localized basis sets in the DFT calculations. …”
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    Locally sparse function-on-function regression by Mauro Bernardi (418110)

    Published 2022
    “…This is achieved using a suitable basis representation of the functional regression coefficient and exploiting an overlapping group-Lasso penalty for its estimation. …”
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