Showing 21 - 40 results of 1,459 for search '(((( algorithm wave function ) OR ( algorithm steps function ))) OR ( algorithm python function ))', query time: 0.54s Refine Results
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    Fig 3 - by Maryam Shadi (14237349)

    Published 2022
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    Fig 8 - by Maryam Shadi (14237349)

    Published 2022
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    Fig 6 - by Maryam Shadi (14237349)

    Published 2022
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    Fig 11 - by Maryam Shadi (14237349)

    Published 2022
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    State Preparation in Quantum Algorithms for Fragment-Based Quantum Chemistry by Ruhee D’Cunha (8921372)

    Published 2024
    “…The localized active space–unitary coupled cluster (LAS–UCC) algorithm iteratively loads a fragment-based multireference wave function onto a quantum computer. …”
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    BOFdat Step 3: Identifying species-specific metabolic end goals. by Jean-Christophe Lachance (6619307)

    Published 2019
    “…<p>(A) After Step 3, the entire weight of the cell is accounted for by BOFdat. …”
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    Python-Based Algorithm for Estimating NRTL Model Parameters with UNIFAC Model Simulation Results by Se-Hee Jo (20554623)

    Published 2025
    “…This algorithm conducts a series of procedures: (1) fragmentation of the molecules into functional groups from SMILES, (2) calculation of activity coefficients under predetermined temperature and mole fraction conditions by employing universal quasi-chemical functional group activity coefficient (UNIFAC) model, and (3) regression of NRTL model parameters by employing UNIFAC model simulation results in the differential evolution algorithm (DEA) and Nelder–Mead method (NMM). …”
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    <b>Opti2Phase</b>: Python scripts for two-stage focal reducer by Morgan Najera (21540776)

    Published 2025
    “…</li></ul><p dir="ltr">The scripts rely on the following Python packages. Where available, repository links are provided:</p><ol><li><b>NumPy</b>, version 1.22.1</li><li><b>SciPy</b>, version 1.7.3</li><li><b>PyGAD</b>, version 3.0.1 — https://pygad.readthedocs.io/en/latest/#</li><li><b>bees-algorithm</b>, version 1.0.2 — https://pypi.org/project/bees-algorithm</li><li><b>KrakenOS</b>, version 1.0.0.19 — https://github.com/Garchupiter/Kraken-Optical-Simulator</li><li><b>matplotlib</b>, version 3.5.2</li></ol><p dir="ltr">All scripts are modular and organized to reflect the design stages described in the manuscript.…”
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