Over the past few years, chemical conversion of CO2 to alternative fuels such as methanol, dimethyl ether (DME), and hydrocarbons (HCs) is one of the hot topics in chemical engineering. Taking this into consideration, we have investigated the effects of wide range of temperature, pressure and H2/CO2 ratio (with and without CO) on the hydrogenation of CO2 to methanol, DME, and HCs by minimizing the Gibbs free energy. The energy calculations indicate that HC synthesis reaction has the minimum Gibbs free energy change. High pressure, low temperature, and high H2/CO2 ratio favored the methanol and DME synthesis. The HC synthesis is favored by high pressure, low temperature, and high H2/CO2 ratio, but the presence of CO has a major effect on the HC selectivity. The presence of CO suppresses CO2 conversion in all the three reactions studied. CO2 conversion is maximum for the HC synthesis at H2/CO2 > 3. The experimental data obtained from laboratory scale fixed bed reactor show a reasonable comparison with the simulation results. The thermodynamic analysis combined with the catalyst development and chemical kinetics are expected to lead towards a competent methodology for CO2 conversion. © 2018 American Institute of Chemical Engineers Environ Prog, 38: 98–111, 2019

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Revealing the influence of preparation method on activity and physio-chemical properties of supported Ga3Ni5 catalysts and thermodynamic modeling of reaction results.

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The global warming and change in climatic conditions due to rising concentration of CO2 in atmosphere are the most important challenges of 21st century. Catalytic conversion of CO2 to methanol will not only check global warming but also provide an alternative source of fuel. The phase purity of solid catalysts has a considerable influence on the desired product selectivity. Reduction temperature is one of the most important parameters responsible for catalyst phase formation. Herein, the effect of a range of reduction temperatures between 100 and 600°C on the phase composition of Pd–Ga bimetallic catalyst and CO2 hydrogenation to methanol activity was investigated. X‐ray diffraction (XRD) analysis revealed the formation of different phases at different reduction temperatures. The variation in catalyst structure was also analyzed using field emission scanning electron microscope‐energy dispersive X‐ray spectroscopy (FESEM‐EDS), Brunaue–Emmett–Teller, H2 chemisorption, and transmission electron microscopy techniques. The influence of reduction temperature, pressure (1–25 bar), H2/CO2 ratio (3–9), and reaction temperature (150–250°C) on methanol and CO selectivity from CO2 hydrogenation at atmospheric pressure was also studied. © 2019 Society of Chemical Industry and John Wiley & Sons, Ltd.

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