Wasteomics ⇒ a workflow to analyze complex reaction environments, waste, and realistic feeds conversions



Problem statement

In most heterogeneous catalytic processes, the reactive environment contains a mixture of reactants, intermediates, and products, and some adsorbed-trapped on the catalytic surface and elsewhere. Thus, most reacting environments in catalysis are complex, involve several phases (multiphase), and comprise unstable species or are challenging to analyze. To make things worse, some of these species have (auto-)catalytic or deactivating nature on the kinetics of the surrounding ones.

A typical practice in catalysis is using model molecules or surrogates to deepen into the mechanistic pathways, microkinetics, spectroscopy, etc. Conversely, analytical techniques keep evolving, becoming more precise but always targeting a specific fraction or type of species. That is to say, there is only one technique that solves all.

We aim to bridge the fundamental research performed in our group and outside using model molecules with a powerful analytical multi-technique approach to analyze the entire reaction media. The -omics fields inspire us to reflect on the collective characterization and quantification of pools of molecules that translate into the structure, function, and dynamics involved. We apply our approach to hydrocarbon transformations and green-sustainable feedstock (i.e., waste plastics, sewage sludge, biomass, algae, and seaweed). We develop multi-technique analytical protocols for the complete chemical molecular-level description of complex mixtures.

Goals

  • Analytical workflow ⇒ multi-analytical technique integration
  • Wasteometrics I ⇒ quantitative- and molecular-level analysis
  • Wasteometrics II ⇒ data mining and processing
  • Wasteomics ⇒ reaction networks and kinetic modeling

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Related Publications

Opportunities and Barriers for Producing High Quality Fuels from the Pyrolysis of Scrap Tires

by Hita, Arabiourrutia, Olazar, Bilbao, Arandes, Castaño
Renew. Sustain. Energy Rev. Year: 2016

Extra Information

Highly Cited Paper and Hot Paper according to Essential Science Indicators.

Abstract

The 7·106 t of waste tires that are generated yearly represent for a potential source of fuels considering its composition, rich in C and H, and its chemical features. Waste tires can be recycled through several processes aiming for either material, energy, or chemical product recovery. In this work we review the current status of these valorization pathways, with a particular focus on pyrolysis, its main products and their characteristics. Despite the extended reviews on the pyrolysis of tires, scarce material is available regarding the possibilities that scrap tires pyrolysis oil (STPO) offers and its limitations. STPO is both the most economically and energetically attractive product, and its composition (as obtained by different authors) is analyzed in this work, finding that the main barriers to solve for its direct implementation are (i) high sulfur content, (ii) high content of aromatics and (iii) high proportion of heavy molecules (>350 °C). From an industrial perspective, a sequential 2-stage hydrotreating–hydrocracking strategy has been proposed for STPO upgrading in order to simultaneously overcoming all these limitations and produce high quality fuels.

Keywords

HPC W2C CRE ANW