Theoretical and Natural Science
- The Open Access Proceedings Series for Conferences
Theoretical and Natural Science
Vol. 36, 28 May 2024
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Using Brownian model to study the effect of temperature on diffusion coefficient
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Abstract
This study employs molecular simulation techniques, particularly the Brownian motion model, to investigate the influence of temperature on diffusion coefficients. Leveraging Einstein’s relationship for calculating diffusion coefficients and a one-dimensional random walk model, we systematically explore the impact of simulation direction, particle quantity, and simulation duration on diffusion behavior. The research extends its scope to three-dimensional Brownian motion simulations, offering insights into the stochastic motion of particles in a fluid. The primary objective is to analyze the relationship between temperature and diffusion coefficients. Through rigorous linear regression analysis, a significant and strong linear association is identified, demonstrating that an increase in temperature correlates with an increase in the diffusion coefficient. The research not only contributes to the fundamental understanding of molecular motion but also provides practical recommendations for simulation parameters, especially in resource-constrained computational environments. The study acknowledges certain limitations in the current Brownian motion algorithm and proposes avenues for future research to enhance computational efficiency and precision. This abstract encapsulates the key methodologies, findings, and implications of the research, laying the foundation for a comprehensive exploration of temperature-dependent diffusion coefficients in molecular systems.
Keywords
Brownian motion, Diffusion coefficient, Temperature-dependent dynamics, Random walk simulations
References
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Data Availability
The datasets used and/or analyzed during the current study will be available from the authors upon reasonable request.
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- Volume Title
- Proceedings of the 2nd International Conference on Mathematical Physics and Computational Simulation
- ISBN (Print)
- 978-1-83558-441-5
- ISBN (Online)
- 978-1-83558-442-2
- Published Date
- 28 May 2024
- Series
- Theoretical and Natural Science
- ISSN (Print)
- 2753-8818
- ISSN (Online)
- 2753-8826
- DOI
- 10.54254/2753-8818/36/20240511
- Copyright
- 28 May 2024
- Open Access
- This article is an open access article distributed under the terms and conditions of the Creative Commons Attribution (CC BY) license, which permits unrestricted use, distribution, and reproduction in any medium, provided the original work is properly cited