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References

Mk-learning-python07 edited this page Sep 16, 2026 · 2 revisions

References

Theory

  • Ruthven, D.M. (1984). Principles of Adsorption and Adsorption Processes. Wiley. ISBN 978-0-471-86606-0.
  • Wilkins, N.S., Rajendran, A. & Farooq, S. (2021). Dynamic column breakthrough experiments for measurement of adsorption equilibrium and kinetics. Adsorption 27, 397–422. doi:10.1007/s10450-020-00269-6

Materials and isotherms

  • Haghpanah, R., Majumder, A., Nilam, R., Rajendran, A., Farooq, S., Karimi, I.A. & Amanullah, M. (2013). Multiobjective optimization of a four-step adsorption process for postcombustion CO₂ capture via finite volume simulation. Ind. Eng. Chem. Res. 52(11), 4249–4265. doi:10.1021/ie302658y
  • Wilkins, N.S. & Rajendran, A. (2019). Measurement of competitive CO₂ and N₂ adsorption on Zeolite 13X for post-combustion CO₂ capture. Adsorption 25(2), 115–133. doi:10.1007/s10450-018-00004-2
  • Dantas, T.L.P., Luna, F.M.T., Silva, I.J., Torres, A.E.B., de Azevedo, D.C.S., Rodrigues, A.E. & Moreira, R.F.P.M. (2011). Carbon dioxide–nitrogen separation through adsorption on activated carbon in a fixed bed. Chem. Eng. J. 169(1–3), 11–19. doi:10.1016/j.cej.2010.08.026
  • Rajagopalan, A.K., Avila, A.M. & Rajendran, A. (2016). Do adsorbent screening metrics predict process performance? Int. J. Greenhouse Gas Control 46, 76–85. doi:10.1016/j.ijggc.2015.12.033
  • Nguyen, T.T.T., Lin, J.-B., Shimizu, G.K.H. & Rajendran, A. (2022). Separation of CO₂ and N₂ on a hydrophobic metal organic framework CALF-20. Chem. Eng. J. 442, 136263. doi:10.1016/j.cej.2022.136263

Numerics

  • Hindmarsh, A.C. et al. (2005). SUNDIALS: suite of nonlinear and differential/algebraic equation solvers. ACM Trans. Math. Softw. 31(3), 363–396. doi:10.1145/1089014.1089020
  • Gardner, D.J. et al. (2022). Enabling new flexibility in the SUNDIALS suite. ACM Trans. Math. Softw. 48(3). doi:10.1145/3539801
  • Demmel, J.W., Gilbert, J.R. & Li, X.S. (1999). SuperLU_MT Reference Guide.
  • Randall, C. (2024). scikit-sundae. https://pypi.org/project/scikit-sundae/

Developed by Muthukrishnan Anand, with the assistance of Claude (Anthropic).

Bug reports and questions: please open an issue.

How to cite

Anand, M. (2026). Dynamic Column Breakthrough Simulator (version 2026.09v2) [computer software]. https://github.com/Mk-learning-python07/dynamic-column-breakthrough

Please also cite the underlying sources for whichever preset and theory your result depends on — they are listed below and reproduced in every exported report.


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