A neural recommender system for efficient adsorbent screening
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Computational screening of metal-organic frameworks for ethylene purification from ethane/ethylene/acetylene mixture
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Hierarchical ionic liquid screening integrating COSMO-RS and aspen plus for selective recovery of hydrofluorocarbons and hydrofluoroolefins from a refrigerant blend
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High-throughput computational screening of ionic liquids for butadiene and butene separation
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Identification of optimal metal-organic frameworks by machine learning - structure decomposition, feature integration, and predictive modeling
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Integrated metal-organic framework (MOF) and pressure/vacuum swing adsorption process design - MOF matching
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Interpretable machine learning for accelerating the discovery of metal-organic frameworks for ethane/ethylene separation
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Multiscale process systems engineering - analysis and design of chemical and energy systems from molecular design up to process optimization
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Optimal design of non-isothermal supercritical water gasification reactor - from biomass to hydrogen
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A new machine learning framework for efficient MOF discovery - application to hydrogen storage
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A novel machine learning-based optimization approach for the molecular design of solvents
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Metal-organic framework targeting for optimal pressure swing adsorption processes
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Computer-aided molecular design of solvents for chemical separation processes
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Energy-efficient recovery of tetrahydrofuran and ethyl acetate by triple-column extractive distillation - entrainer design and process optimization
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Hybrid data-driven and mechanistic modeling approaches for multiscale material and process design
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Integrated ionic liquid and rate-based absorption process design for gas separation - global optimization using hybrid models
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Integrated metal-organic framework and pressure/vacuum swing adsorption process design - descriptor optimization
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Model-based thermodynamic analysis of supercritical water gasification of oil-containing wastewater
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Computer-aided screening of deep eutectic solvent systems for the associative extraction of α-tocopherol from deodorizer distillate
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Rational design of ionic liquid phase-change material for efficient thermal energy storage
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Comparative economic analysis of physical, chemical, and hybrid absorption processes for carbon capture
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Computer-aided solvent selection and design for efficient chemical processes
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Extending the UNIFAC model for ionic liquid-solute systems by combining experimental and computational databases
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Investigation of energy-efficient and sustainable reactive/pressure-swing distillation processes to recover tetrahydrofuran and ethanol from the industrial effluent
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Model-based optimal design of phase change ionic liquids for efficient thermal energy storage
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Prediction of CO2 solubility in ionic liquids using machine learning methods
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Screening of functional solvent system for automatic aldehyde and ketone separation in aldol reaction - a combined COSMO-RS and experimental approach
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Systematic screening of deep eutectic solvents as sustainable separation media exemplified by the CO 2 capture process
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In silico screening of metal-organic frameworks for acetylene/ethylene separation
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Big data creates new opportunities for materials research - a review on methods and applications of machine learning for materials design
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Optimal solvent design for extractive distillation processes - a multiobjective optimization-based hierarchical framework
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Rational design of double salt ionic liquids as extraction solvents - separation of thiophene/ n octane as example
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Computer-aided design of ionic liquids as solvents for extractive desulfurization
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Integrated process and ionic liquid design by combining flowsheet simulation with quantum-chemical solvent screening
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A hybrid stochastic-deterministic optimization approach for integrated solvent and process design
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Systematic method for screening ionic liquids as extraction solvents exemplified by an extractive desulfurization process
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A hybrid stochastic-deterministic optimization approach for integrated solvent and process design
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Optimal design of solvents for extractive reaction processes
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Systematic methods for reaction solvent design and integrated solvent and process design
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Integrated solvent and process design exemplified for a Diels-Alder reaction
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Robust design of optimal solvents for chemical reactions-A combined experimental and computational strategy
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Model-based method for the screening of solvents for chemical reactions
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Reprint of: Simulation based ionic liquid screening for benzenecyclohexane extractive separation
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An overview of mutual solubility of ionic liquids and water predicted by COSMO-RS
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Evaluation of the ionic liquids 1-alkyl-3-methylimidazolium hexafluorophosphate as a solvent for the extraction of benzene from cyclohexane: (Liquid + liquid) equilibria
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Selective oxidation of cyclohexanol to cyclohexanone in the ionic liquid 1-octyl-3-methylimidazolium chloride
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