01739nas a2200253   4500008004100000022001400041245012800055210006900183260000900252490000700261520089200268653000901160653000801169653001501177653001301192653002601205100002101231700002101252700002201273700001601295700002901311700001801340856012701358       2023                        eng d  a1867-388000aMechanistic insights into near ambient pressure activity of intermetallic NiZn/TiO2 catalyst for CO2 conversion to methanol0 aMechanistic insights into near ambient pressure activity of inte  cJAN 0 v153 a<p>
	Ni-Zn pair is predicted through descriptor-based studies to be conducive for CO2 hydrogenation. In this study, NiZn (1 : 1) intermetallics supported on TiO2 is identified as a potential candidate for near ambient pressure activity. The effect of reduction temperature on the catalyst textural properties as well as on CO2 to methanol reduction are explored. Structural and microscopic studies provide clear evidence of phase evolution of NiZn alloy with increasing reduction temperatures, along with phase variations of Zn based oxides. Interface between NiZn intermetallics and ZnO nanoparticles observed at reduction temperature of 550 degrees C, seems to play a crucial role in making this system most active and selective to methanol. In addition, in-situ IR studies provide mechanistic insights and indicates the formation of methanolic species even at ambient pressure.</p>
10aCCUS10aCO210aIn-situ IR10aMethanol10anear ambient pressure1 aDongapure, Pavan1 aTekawadia, Jyoti1 aThundiyil, Shibin1 aCaha, Ihsan1 aDeepak, Francis, Leonard1 aDevi, Nandini  uhttps://library.ncl.res.in/content/mechanistic-insights-near-ambient-pressure-activity-intermetallic-nizntio2-catalyst-co202183nas a2200241   4500008004100000022001400041245011100055210006900166260000800235300001000243490000800253520135800261653001901619653001801638653002501656653002201681653001301703100002601716700002101742700002301763700002901786856012601815       2024                        eng d  a0263-876200aExperimental and kinetic modelling studies for the design of fixed bed methanol reactor over CuZA catalyst0 aExperimental and kinetic modelling studies for the design of fix  cMAY  a79-900 v2053 a<p>
	Direct conversion of CO 2 via hydrogenation to value-added chemicals is a vital approach for utilising CO 2 emitted into the atmosphere. In this paper, a critical analysis of reaction kinetic modelling studies is explored in a fixed bed reactor to improve methanol yield for different H 2 to CO 2 ratios by simulating a lab-scale reactor for adiabatic and isothermal conditions. The feed inlet temperature and pressure variations are applied to study the effect of both configurations on methanol production. The results show that the isothermal configuration yields 2.76% more methanol yield compared to the adiabatic reactor. The effect of H 2 to CO 2 molar ratios of 3, 6 and 9 on the performance of the catalyst and the influence of CO and CO 2 hydrogenation is investigated with model simulations. The overall methanol yield is increased from 19.03% to 36.41% with increase in H 2 to CO 2 molar ratio from 3 to 9. Experiments are performed using commercial copper-based catalyst for different temperatures of 210, 230 and 250 degrees C at a pressure of 40 bar for H 2 /CO 2 of 3 and GHSV of 720 h -1 as well as at optimal temperature of 250 degrees C and 50 bar with varying H 2 /CO 2 of 3, 6, 9 for 3 g and 6 g catalyst. The maximum methanol yield of 2.53% and space time yield of 13.59 mg/g cat .h is obtained at H 2 /CO 2 ratio of 9.</p>
10aCO2 conversion10aCuZA catalyst10aH2 toCO2 molar ratio10aKinetic modelling10aMethanol1 aBagwan, Farahanaz, M.1 aDongapure, Pavan1 aKulkarni, Amol, A.1 aVasireddy, Satyam, Naidu  uhttps://library.ncl.res.in/content/experimental-and-kinetic-modelling-studies-design-fixed-bed-methanol-reactor-over-cuza