AI-enabled lithium carbonate production with integrated CO2 capture, boosting and optimizing sustainable Li-ion battery production.
Data Analysis for my Bachelor Thesis "Dynamical changes of polyethylene imine in porous silica upon CO_2 sorption"
A comprehensive framework of AIMD simulations and Rietveld refinement data explaining the 3.2-fold enhancement of CO2 adsorption in humid Cs-RHO zeolites.
Aspen HYSYS simulation of CO₂ capture using Temperature Swing Adsorption (TSA), comparing PEI-impregnated silica gel and activated carbon.
CO₂ACT (CO₂ Amine Calorimetry and Thermodynamics) is a mechanistic modeling framework for simulating aqueous CO₂–amine systems. It predicts pH, solution speciation, and reaction thermodynamics by coupling carbonate chemistry, acid–base equilibria, carbamate formation, and titration or ITC experiments for parameter estimation and analysis.
MATLAB model for continuous TSA-based CO₂ capture from biomass flue gas using Toth isotherms and energy optimization.
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