Search results for "reforming"
showing 8 items of 18 documents
DFT investigation of polyalcohols reforming on palladium cluster
2015
Biomass conversion technologies have recently gained high industrial interest for the production of sustainable fuels and fine chemicals; starting feedstocks for these processes are generally complex mixtures of oxygenated compounds, ranging from lignans, carbohydrates and polyalcohols to carboxylic acids [1]. Framed within this scientific context the entire reforming mechanism of two well-known polyols, namely ethylen glycol (C2) and glycerol (C3), on a small Pd cluster was investigated by means of density functional theory. Among the large amount of reaction pathways that can be followed in the reforming of oxygenates, we discuss here only the route that brings to carbon monoxide and hydr…
Photocatalytic Solar Light H2 Production by Aqueous Glucose Reforming
2018
Photocatalytic Solar Light H2 Production by Aqueous Glucose Reforming
In situ ATR-IR studies in aqueous phase reforming of hydroxyacetone on Pt/ZrO2 and Pt/AlO(OH) catalysts: The role of aldol condensation
2018
Abstract In situ Attenuated Total Reflection Infrared (ATR-IR) spectroscopy was used to study Aqueous Phase Reforming of hydroxyacetone on Pt/AlO(OH) and Pt/ZrO2 catalysts at 230 °C/ 30 bar. Formation of strongly adsorbed aldol condensation products was observed on the surface of Pt/ZrO2 and ZrO2 in contrast to Pt/AlO(OH) and AlO(OH). Peak assignments were supported by DFT calculations of the IR spectra of the condensation products in vacuum and in the presence of water. Aldol condensation of hydroxyacetone leading to compounds with high molecular weight with unsaturated bonds was suggested as a first step in coke formation. Carbonaceous deposits on the surface of the ZrO2 support are oxyge…
On the electrochemical reduction of carbon dioxide and ethylene
1973
Die gemeinsame Elektrolyse von Athylen (I) und Kohlendioxid (II) liefert je nach den angewandten Bedingungen Mischungen aus Oxalsaure (III) und Bemsteinsaure (IV).
Photoreforming of organics in aqueous suspension of Nb2O5/C3N4 composites to obtain H2
2023
Photocatalysis based on the use of semiconductors has gained, during the recent years, increased attention as promising sustainable process for H2 and fine chemicals production, given the possibility of activating such photocatalysts by visible light radiation. The photo-reforming activity in this work has been measured under both UV-LED irradiation and natural sunlight illumination. Moreover, the presence of metallic Pt as co-catalysts has been studied. Carbon nitride (C3N4) based materials are good candidates for solar energy conversions. The choice of C3N4 and Nb2O5 arises from the fact that their heterojunction can lead to lower recombination between the photo-generated electrons and ho…
Photocatalytic H2 evolution from aqueous solutions of oxygenated organic compounds in the presence of C3N4/reduced graphene oxide based photocatalysts
2022
Composites of C3N4/reduced graphene oxide have been used as a cheap and promising photocatalysts for triethanolamine and ethanol photo-reforming with H2 generation in aqueous solution. The rate of H2 production over the best performing photocatalysts reached 1,415 μmol·h-1·g-1 which increases up to 57,306 in the presence of 1% of Pt. The apparent quantum efficiency of the optimal material was 7 % by using both LED and natural sunlight irradiation
Photocatalytic Generation of H2 by Photoreforming of Organics in Aqueous Suspension of Nb2o5/C3n4 Composites
2023
Bare and composite materials based on C3N4 and Nb2O5 have been used as photocatalysts for the photoreforming of aqueous solutions of oxygenated compounds. Both Nb2O5 and Nb2O5/C3N4 composites have been prepared by hydrothermal synthesis and all of them were physical-chemically characterized. In this work two different carbon nitride species i.e. graphitic (g-C3N4) or thermo-etched (TE-C3N4) were used both alone or coupled with Nb2O5. The photo-reforming activity has been measured under UV irradiation by using the semiconductors in the presence of Pt as co-catalysts and, in the case of the best material, it was, for the first time, measured and compared also under natural solar irradiation. …
Understanding Structure and Stability of Monoclinic Zirconia Surfaces from First-Principles Calculations
2017
Under the water-rich pre-treatment and/or reaction conditions, structure and chemistry of the monoclinic zirconia surfaces are strongly influenced by oxygen vacancies and incorporated water. Here, we report a combined first-principles and atomistic thermodynamics study on the structure and stability of selected surfaces of the monoclinic zirconia. Our results indicate that among the studied surfaces, the most stable (111) surface is the least vulnerable towards oxygen vacancies in contrast to the less stable (011) and (101) surfaces, where formation of oxygen vacancies is energetically more favorable. Furthermore, we present a vigorous, systematic screening of water incorporation onto the s…