February 2025
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52 Reads
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February 2025
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52 Reads
February 2025
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13 Reads
ACS Sustainable Chemistry & Engineering
January 2025
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78 Reads
January 2025
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26 Reads
Journal of the American Chemical Society
January 2025
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11 Reads
ACS Sustainable Chemistry & Engineering
Replacing fossil carbon- with renewable carbon-based technologies is imperative for transitioning to sustainable chemical production. However, most production pathways based on renewable carbon are currently economically unappealing. Here, we show that hybrid clusters exploiting synergies between different fossil and renewable carbon-based processes in terms of heat, mass, and power integration could make defossilized chemical technologies more competitive. We consider an integrated carbon cluster based on fossil and renewable carbon feedstocks for methanol production, including a novel oxy-combustion cycle for purge gas treatment and power generation. Using multiobjective optimization considering economic and environmental criteria (i.e., unitary production cost and global warming potential (GWP) impact, respectively), we find that integrated clusters could reduce the cost of carbon-neutral methanol by up to 30%, while leading to reductions in GWP impact from 21 to 142% for a given unitary production cost target, and heating utility savings between 80 and 100%. We conclude that hybridization of fossil and renewable technologies could become instrumental in enabling a gradual shift toward sustainable chemical production pathways.
January 2025
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13 Reads
ACS Sustainable Chemistry & Engineering
Current efforts to decarbonize the chemical sector by using captured CO2 and electrolytic H2 typically lead to high production costs and environmental collateral damage. Hence, there is a clear need to look for alternative, more efficient synthesis routes that could pave the way for a fully sustainable chemical industry. Bearing this in mind, here, we evaluate the economic and environmental implications of two low technology readiness level (TRL) novel single-step synthesis routes for acetic acid production using CO2 as a raw material: gas-to-acid methane carboxylation and semiartificial photosynthesis. Using process simulation and life-cycle assessment, we determine that these pathways, under a specific set of assumptions, could outperform the business-as-usual methanol carbonylation process at their current development state in terms of global warming, human health, ecosystem quality, and resource scarcity impacts, showing no signs of burden shifting. Furthermore, these routes also result in lower production costs derived from the reduced energy requirement associated with a single synthesis step. Overall, our preliminary results of the low TRL technologies based on experimental data highlight the potential economic and environmental benefits of exploring alternative synthesis routes, which could help bridge the current fossil-based industrial landscape to a more sustainable future.
January 2025
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11 Reads
Industrial & Engineering Chemistry Research
Replacing fossil technologies with renewable carbon-based technologies is of vital importance for the development of sustainable chemical processes in the future. However, impacts beyond climate change should be carefully evaluated to ensure that this transition to defossilized chemicals is truly sustainable. Here, we develop a framework for sustainable process design that explicitly accounts for the performance attained in the Sustainable Development Goals (SDGs), which is computed using standard life cycle assessment (LCA) metrics alongside the planetary boundaries (PBs) concept. We apply this approach to design a CO2 hydrogenation to methanol process, where economic and SDGs-based performance are the objectives optimized. We show that the environmentally optimal design reduces the impact on SDG 13 (climate action) substantially relative to the business-as-usual (BAU) fossil counterpart, yet this is done at the expense of worsening other categories. A prospective LCA reveals that such collateral damage will be drastically reduced in the future due to improvements in a range of economic sectors. Overall, this work highlights the need to embrace impacts beyond climate change in process design and the advantages of using hybrid surrogates to expedite the computation of Pareto designs.
January 2025
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19 Reads
iScience
In 2022, the European Union put forward the REPowerEU plan in response to Russia’s invasion of Ukraine, aiming at enhancing short-term energy security by diversifying imports and reducing natural gas demand while accelerating the deployment of renewable alternatives in the long term. Here, we quantify the life cycle environmental impacts of both REPowerEU’s short-term measures, including the controversial extended coal-fired power plant operations, and how the first year of the crisis was managed in practice. We find that the policy measures’ impact on greenhouse gas (GHG) emissions would be negligible, although they could have detrimental effects on other environmental categories. In practice, GHG emissions dropped by 8.6% driven by energy savings, yet other environmental burdens worsened, primarily due to coal and oil use. Our results could support the development and analysis of long-term policies to enhance energy security via natural gas demand reduction while considering multiple environmental sustainability indicators to avoid collateral damage.
December 2024
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34 Reads
One Earth
November 2024
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17 Reads
Sustainable Production and Consumption
... [16] In recent work, we showed that DFX is inherently biodegradable and scaled up the production of DFX from corn cobs to a multi-kg scale in a sustainable one-pot process. [28] By adapting the same process, in this work we expand the portfolio of xylose-based solvents by introducing various short-chain aliphatic aldehydes into the xylose core. The resulting xylose acetals are interesting candidates for biocatalysis and, specifically, for polyester syn-thesis with Candida antarctica lipase B (CaLB) due to their properties discussed in this work. ...
August 2024
ACS Sustainable Chemistry & Engineering
... Substantially increasing CDR employment would correspond to scaling up novel CDR methods, as maintaining or even slightly increasing conventional CDR on land by 2030, as planned by many countries and economic regions like the European Union, is a huge challenge on its own requiring dedicated policies and management (Doelman et al., 2020;Cobo et al., 2023;Gidden et al., 2023;Smith et al., 2023;Ganti et al., 2024;Koponen et al., 2024;Zhao et al., 2024). Further, there are major uncertainties regarding incomplete GHG emission measurements and accounting related to such nature-based climate change mitigation and CDR methods (Buma et al., 2024). ...
August 2024
... Besides climate change impacts, biobased chemicals may lead to burden shifts, particularly in terms of water scarcity and land use-related biodiversity loss. These impacts require careful assessment at the regional level to fully understand and mitigate their consequences (Huo et al., 2024). ...
July 2024
Environmental Science and Technology
... 1−4 However, this sector remains one of the most energy-intensive and carbonemitting, heavily reliant on fossil fuels as both feedstocks and energy sources. 5,6 This has spurred the emergence of electrocatalysis, a revolutionary platform that bridges the gap between renewable energy and chemical manufacturing. 7 By leveraging electricity�especially from solar, wind, and hydro-power�electrocatalysis enables the conversion of simple, abundant molecules into high-value chemicals and fuels, such as hydrogen, ammonia, formic acid, and hydrogen peroxide. ...
May 2024
... World Wide Web was introduced in the early 1990s as a global information interchange system [3]. Since then, the web has transformed into the most significant available application platform thanks to the advent of web applications, as the platform reaches two-thirds of the global population these days [18,45]. To enable applications on top of the web, the platform had to be retrofitted to suit the purpose while the amount of dynamic functionality on websites has been growing. ...
May 2024
... In this regard, Boyce et al. 15 analyzed global ammonia decarbonization scenarios, concluding that while up to 70% reduction could be achieved in climate impacts, complete decarbonization of this sector is unlikely by 2050. Moreover, Nabera et al. 16 presented regionalized prospective LCAs of key platform chemicals, concluding that green routes could achieve up to 90% carbon emissions reductions. ...
June 2024
Green Chemistry
... With regard to the transition to a BE, the relevance of the product groups of the bio-based value pyramid in terms of value and volume must change. Bioplastics and polymers as well as bulk chemicals and materials are in focus of research and seem to gain in importance and market share (Mitchell et al. 2024;Shah et al. 2020). Energy, heat and fuels from biomass are supposed to be surpassed by other renewable energies not based on biomass (European Commission 2021a). ...
April 2024
... Surrogate-based optimization has also been applied to process systems for resource recovery from wastewater, integrating DFO modeling tools that incorporate classification surrogate models and address uncertainties, thereby offering holistic solutions to reduce environmental impacts in food and beverage production [15]. In addition to the above, many other surrogates have been used, from Graph Neural Networks (GNNs) for Granular Flows [20], to symbolic regression-based surrogates for flexibility analysis [21], to Quantile Neural Networks for Two-stage Stochastic Optimization [22]. An overview of data-driven and hybrid models for subsequent optimization of separation processes can be found in [23]. ...
February 2024
Computers & Chemical Engineering
... Their study demonstrated that, when integrated with efficient stochastic algorithms, these data-driven models can identify high-quality optimal solutions while significantly reducing the computational time. [33][34][35] lists selected examples of state-of-the-art developments in the application of AI in process synthesis and design. The first example is an AI-based multi-level flowsheet representation and generation framework that incorporates text-based, hypergraph-based, and ontology-based methods with embedded model-based calculation tools [17], where flowsheets at each level, represented by the extended simplified flowsheet-input line-entry system (eSFILES), are connected with process generators, process simulators, and inferencing algorithms to solve various flowsheet-related interconnected problems. ...
December 2023
Computers & Chemical Engineering
... The renewable-based route utilizes the SOEC powered by wind electricity to produce H 2 and O 2 . The SOEC is modeled based on the work by D'Angelo et al., 47 in which an inlet water stream is heated up before entering the SOEC, where H 2 and O 2 are produced. The electrolysis products are cooled down, and unconverted water is separated from H 2 in a flash unit. ...
December 2023
ACS Sustainable Chemistry & Engineering