The application of binary algorithm on 3D numerical modeling of chemistry reac..

hliu092

Introduction: This model designs a 3D numerical modeling of chemistry reaction rate by adopting the three-dimensional arrays. The [0,1] binary algorithm is used to simulate the probability of molecule occurrence in the spatial grids of this 3D model. Active chemistry bond is taken into consideration in the functions calculating the chemistry reaction rate.

   

Development language: C++;

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Reference: Liu Huan (2025). Fundamental mechanics: from classical mechanics to quantum mechanics and its application on quantum chemistry. Journal of Quantum Physics and Materials Chemistry (ISSN2958-4027). 2025 (09). https://doi.org/10.58473/JQPMC0014

Article and Software Download: https://doi.org/10.58473/JQPMC0014      

The Source Code is deposited in the publisher's repository (Github): https://doi.org/10.58473/ChengZhuSci0003/06

The DOI for this poster is: https://doi.org/10.6084/m9.figshare.30123766

This software is retrieval from international databases:

Web of Science retrieval URL:https://publons.com/wos-op/publon/79094967/

BASE: Link       Scilit database: Link       PlumX: Link        ScienceOpen: Link