AIChE Journal

Papers
(The TQCC of AIChE Journal is 8. The table below lists those papers that are above that threshold based on CrossRef citation counts [max. 250 papers]. The publications cover those that have been published in the past four years, i.e., from 2022-08-01 to 2026-08-01.)
ArticleCitations
Efficient use of imprinted nanocatalytic particles: Development and application of targeted catalytic membranes61
Efficient in situ cell modeling boosts catalytic microkinetics quantification by transient infrared spectroscopy61
New data sharing requirements for AIChE Journal authors57
Correction to “High‐temperature molecular dynamics simulation of cellobiose and maltose”56
β‐Cyclodextrin modified deep eutectic solvent for recovering valuable metals from retired lithium batteries55
Subsurface Ce dopants in Bi2MoO6 monolayers as promoters for photocatalytic C‐N coupling reaction47
Modeling multicomponent wax deposition and aging on cold surfaces with application to pipeline fouling47
Phenolic/carboxylic functionalized hypercrosslinked polymers for aromatic diamine recovery from polyurethane hydrolysate45
Anchoring hydroxyl intermediate on NiCo(OOH)x nanosheets to enable highly efficient electrooxidation of benzyl alcohols44
A Benders decomposition framework for the optimization of disjunctive superstructures with ordered discrete decisions44
An efficient method for spatiotemporally resolved aerosol flow modeling: Discrete migration and GPU acceleration43
New and simple synthetic strategy for two‐dimensional ultra‐microporous aromatic framework for selective uranium capture in liquid43
Statistical kinetic modeling procedure for cationic polymerization and its application to polyisobutylene42
Founders Issue honoring Tunde Ogunnaike41
Kinetic study in an automatic continuous‐flow photochemical platform with machine learning41
A novel approach to intensify fluid mixing by introducing a “pre‐cavitation” stage in an ultrasonic microreactor39
Liquid film thickness in the slug flow pattern of gas–liquid flow in straight circular microchannels39
Benzimidazole‐and‐amide‐linked thin polymer membranes for H 2 / 38
Quantum chemical calculation driven insights into deep eutectic solvent‐accelerated photoinduced reversible complexation‐mediated polymerization38
38
Experiment and a catalyst acid property‐included global reaction modeling for catalytic pyrolysis of 1‐pentene38
Unveiling flow and mixing mechanism of a vortex microreactor and its use in preparing uniform layered oxide materials38
Nonlinear model predictive control for dividing wall columns37
Mesoporous coordinated polymers with single‐metal‐site iridium for efficient catalysis in propylene hydroformylation37
Multiscale screening of metal‐organic frameworks for one‐step ethylene purification in pressure‐swing adsorption processes37
Preparing methane‐resistant Ru catalysts via moderate metal‐support interactions for polyethylene hydrogenolysis36
Nitrogen rich barbituric acid‐derived porous organic polymer for efficient radioactive iodine adsorption36
Tailoring bubble size through acoustic‐assisted microbubble generation34
Experimental and molecular thermodynamics insights into separating bicyclic aromatics from diesel oil with ionic liquids34
Chaotic advection and mass transfer of viscous liquid–liquid flows in a novel 3D serpentine microchannel34
Manipulating bimetal structure of CuCo at mesoscale via topological transformation of layered double hydroxides34
Partial least squares, steepest descent, and conjugate gradient for regularized predictive modeling34
Superior wetting branched nonionic surfactants from α ‐olefin dimers upgrading via tandem hydroformylation‐hydrogenation34
Ionic liquid binary mixtures: Machine learning‐assisted modeling, solvent tailoring, process design, and optimization33
A surrogate‐based framework for feasibility‐driven optimization of expensive simulations33
Simultaneous ozone and hydrogen peroxide electrosynthesis via defect modulation in Ni, Sb‐doped SnO2 electrocatalysts33
SiC ‐promoted Cu/ ZnO catalysts for efficient CO 32
Vapor‐liquid interfacial properties of binary mixtures from molecular simulation and density gradient theory32
A molecular kinetic model incorporating catalyst acidity for hydrocarbon catalytic cracking31
Chlorine‐dopant dynamically stabilizes Cu0/Cu+ active sites for selective CO2 electroreduction to multicarbon products31
Controllable intensification of turbulent mixing in a dual‐shaft stirred system driven by flexible structures31
Electron‐deficient covalent organic frameworks anchored on melamine sponges for visible‐light‐driven H2O2 evolution31
Converting metal–organic polyhedra to Pd single atoms on graphene for efficient selective semi‐hydrogenation of alkynes30
Activity of bimetallic PdIn/CeO2 catalysts tuned by thermal reduction for improving methanol synthesis via CO2 hydrogenation30
A CFD study of the effect of ridge baffles on the hydrodynamic behavior in gas–solid fluidized system30
Flow reorganization in cohesive granular materials induced by pulsed aeration30
Synergistic SO2 absorption in N‐methyl ethanolamine/thiocyanate blends: Thermodynamic insights and energy optimization30
Ion injection bipolar membrane electrodialysis realizes over 8 mol/L NaOH conversion from a brine stream30
Experimental validation of the RESPONSE framework against cyberattacks on cyber‐physical process systems30
Screening of ionic liquids for HCl absorption and their applicability via a multi‐scale approach29
Analysis of bubble characteristics in gas–liquid–solid micro‐confined fluidized bed29
Boosting lithium storage in silicon anodes by synergistic dual carbon confinement and CoSe 2 29
Predicting initiator efficiency in high‐pressure polymerization with decomposition network and diffusion dynamics29
Tailoring high‐concentration aqueous electrolytes for enhanced anion intercalation behavior in dual‐ion batteries29
Improved theoretical prediction of effective heat transfer parameters in packed beds29
Mechanism and kinetics study of the chemically initiated oxidative polymerization of hexafluoropropylene29
Issue Information ‐ Table of Contents28
Simulation analysis of biomass pyrolysis based on the improved chemical percolation devolatilization model with chain reaction dynamics28
28
28
Numerical study on the hydrodynamics of highly viscous liquid under vertical acoustic vibration28
Tailoring crystal facet microenvironments for simultaneous electrochemical ozone and hydrogen peroxide production27
Mass transfer to a nanoelectrocatalyst27
Numerical simulation of jet break‐up using the local front reconstruction method27
Development and validation of a controlled heating apparatus for long‐term MRI of 3D microfluidic tumor models27
Enhanced catalytic performance of H2SO4‐catalyzed C4 alkylation by formyl functional [N1,1,1,1][C10SO427
Experimental and molecular insights on the regulatory effects of solvent on CaC2 reaction activity26
Flexible design of renewable methanol production systems based on regulation strategy of operating windows26
Multiscale numerical simulation of the evolution of SiO 2 nanoparticles 26
Parameter estimation and prediction uncertainties for multi‐response kinetic models with uncertain inputs26
Quantifying molecular surface barriers and intracrystalline diffusion in nanoporous materials by zero‐length column26
Stoichiometry model identification for homogeneous reaction mixture: High‐dimension and missing measurement case studies26
Machine learning enabled integrated formulation and process design framework for a pharmaceutical 3D printing platform25
Development of a procedure for defining the operation window of annular centrifugal contactors25
An integrated chemical engineering approach to understanding microplastics25
Experimental and computational study on enhanced synergy in CO 2 absorpt25
Impacts of packed bed polydispersity and deformation on fine particle transport25
Insight into the complex ammonia decomposition/oxidation kinetics in ammonia protonic ceramic fuel cells via elementary modeling25
Cavitation behavior and mixing performance of antisolvent precipitation process in an ultrasonic micromixer25
Coupling coarse‐grained DEM‐CFD and intraparticle model for biomass fast pyrolysis simulation and experiment validation24
Proton exchange membrane water electrolysis at high current densities: Response time and gas‐water distribution24
Engineering emulsion‐templated polymer monoliths via substituting a single carbon atom with nitrogen to boost photocatalytic hydrogen evolution24
Curved boron nitride surface enables active and stable propane oxidative dehydrogenation24
Prediction of CO2 solubility in ionic liquids via convolutional autoencoder based on molecular structure encoding24
Selective hydrodeoxygenation of lignin to 4‐ethylcyclohexanol catalyzed by Cu–Ni/MgCrOx spinel24
Development of enhanced three‐dimensional printed packings for scale‐up of distillation columns: A successful case study24
Data‐driven parallel Koopman subsystem modeling and distributed moving horizon state estimation for large‐scale nonlinear processes24
Embedding Dynamic Microkinetic Modeling Information Into Reduced‐Order Models Using Gaussian Processes24
Efficient splitting of C 3 H 6 24
Balancing acetylene and hydrogen chloride adsorption through gold‐copper‐nickel synergistic interactions for enhanced acetylene hydrochlorination24
Maltose hydrogenation to maltitol over industrial Raney Ni catalyst: Kinetics and mechanism23
Demand response potential of industrial processes considering uncertain short‐term electricity prices23
Machine learning boosted eutectic solvent design for CO2 capture with experimental validation23
Surfactant‐modified electrode–electrolyte interface for steering CO2 electrolysis on Cu electrodes23
Anion‐based regulating mechanism of structural and diffusive property of ionic liquids23
Influence of particle z‐potential and experimental procedure on protein corona formation and multicomponent aggregation23
The overall‐process dynamic mass transfer research of surfactant at the three‐phase emulsions interface22
Catalyst‐free ammonolysis of PTT polyester: Thermodynamics, kinetics, and selective recovery of 1,3‐propanediol22
An experimental study of bubbly flow in high‐viscosity liquid in a pseudo‐ 2D bubble column equipped with mesh using high‐speed imaging22
Bimetallic synergistic effect of Co and Fe for the highly efficient catalytic decomposition of ozone22
Mass transfer of CO 2 in biphasic diethylenetriamine–1‐dimethylamino‐2‐p22
22
Polymeric emulsifier and diatom‐inspired membrane synergistically locate enzymes for interfacial cascade reactions22
Property of waste bottle‐grade polyethylene terephthalate restored by Ti‐based catalysts22
Enhancing Bacillus licheniformis sporulation with automatic nitrogen feeding based on online detection of exhaust CO222
Shortcut design method for multicomponent gradient simulated moving beds22
Active‐learning‐based rational inverse design of ionic liquids for interfacial property optimization22
Characteristics of gas residence time distribution in a high‐pressure fluidized bed22
Selectively enriching accessible quantum sieving sites in two‐dimensional carbons for D2/H2 kinetic separation22
Enhancing lithium extraction with π‐electron donor‐based ionic liquids: Molecular thermodynamics and dynamic insights22
Hindered cracking in colloidal suspension coatings via evaporation‐driven lyotropic liquid crystals21
MRI on ion exchange resins at different length scales21
Oxygen‐vacancy‐driven Ni catalyst enables energy‐efficient industrial methanation at low temperatures21
Intensified reactor for lean methane emissions treatment21
Experimental study on the path instability of a porous particle in a quiescent fluid21
Improving wet scrubber efficiency using fiber‐guided drops21
3D models guide the design of hollow fiber membrane contactors with complex internal structures for CO2 capture20
Mechanism and kinetics investigation of reaction network: 1,3‐Dichloro‐2‐propanol with alkali to prepare epichlorohydrin20
Robust generation of monodisperse droplets using a microfluidic step emulsification device with triangular nozzle20
Machine learning‐aided process design using limited experimental data: A microwave‐assisted ammonia synthesis case study20
Polysorbate identity and quantity dictate the extensional flow properties of protein‐excipient solutions20
Numerical study of biomass gasification combined with CO2 absorption in a bubbling fluidized bed20
Experimental study on the differences between bubble and drop breakages in agitated turbulent flows19
Constructing grain boundary to stabilize Cu0/Cu+ interfacial sites for efficient CO2 reduction reaction19
CFDPBM simulation of surfactant effects in bubble columns: Coalescence modeling based on critical velocity19
Accurate ion/solvent separation via pore‐size‐customized MOF membrane for hydrogen evolution‐free aqueous zinc batteries19
The effect of axial impeller geometry on the link between power and flow numbers19
Magnetic Fe‐Ni bimetallic oxide shell nanorods containing anti‐protein polymer segments for protein purification19
Sequential numerical modeling of flocculation‐settling of tailings: A focus on the effect of feed velocity19
Propane dehydrogenation on Ir single‐atom catalyst modified by atomically dispersed Sn promoters in silicalite‐1 zeolite19
Electrified distillation with flash vapor circulation and thermal storage for dynamic electricity markets18
Thermal effect optimization endows a selective and stable PdCu single atom alloy catalyst for acetylene hydrogenation18
Model‐based control of titer and glycosylation in fed‐batch mAb production: Modeling and control system development18
Digital design and optimization of the integrated synthesis and crystallization process using data‐driven approaches18
Synergy of carbanion siting and hydrogen bonding in super‐nucleophilic deep eutectic solvents for efficient CO2 capture18
Physics‐informed constrained bubble generative adversarial network for realistic bubble image generation18
Construction and shaping of polyoxometalate‐based covalent organic framework for boosting one‐pot CO2 conversion18
Lanthanide contraction effect of PdPr nanosheets boosting PET electrocatalytic value‐added convers18
Dynamic optimization of proton exchange membrane water electrolyzers considering usage‐based degradation18
Optimizing particle morphology: Atomic iron–nitrogen centers with graphitic‐N for highly efficient CO2 electroreduction18
Concentration polarization on surface patterned membranes18
Green synthesis of aminated lignin via biocatalytic pathway for removal of Cu( II ) from wastewater18
Gas–liquid mass transfer enhancement by simply modifying a T‐junction microchannel18
A functionalized zwitterionic PAN fiber membrane with enhanced antifouling for stable emulsion separation18
Optimal retrofitting of conventional oil refinery into sustainable bio‐refinery under uncertainty17
Periodic particle concentration oscillations in slot coating of concentrated suspensions with shear‐induced migration17
Engineering single‐atom equivalent trapping site for photothermal CO2 selective hydrogenation17
A superstructure‐based optimization model for Polyethylene furandicarboxylate production17
17
Mapping uncertainty using differentiable programming17
Molecular‐level insight on CO2 electroreduction to formate facilitated by triazole ionic liquid interfacial microhabitat17
Intensification of diethyl methylphosphite synthesis based on kinetics study and CFD modeling17
Digital supply chain: An industrial perspective17
Characterizing binary droplet collisions of power‐law fluids17
An environmental corrected descriptor based on d‐orbital spin states for atomically dispersed dual‐metal catalysts17
First principle based rate equation (1pRE) for random pore model in Fe2O3 reduction reaction with CO17
Issue Information ‐ Table of Contents17
Synergistic plasmon resonance hybridization of iron‐dispersed MoO3x/MXene for enhanced nitrogen photothermal reduction17
Science‐guided data analytics for selecting ionic liquid solvents for aromatic extraction17
The contact angle and structure of water on the graphite‐like substrate: A classical density functional approach17
Elucidating dechlorination of waste polyvinyl chloride under high‐temperature catalytic hydrothermal treatment17
Innovative packed‐bed ion‐distillation for direct lithium extraction17
Particle tracking velocimetry study of the nonequilibrium characteristics of a fluidized bed17
Rational screening of metal catalysts for selective oxidation of glycerol to glyceric acid from microkinetic analysis17
Atomic size mismatch induced consecutive compressive strain on intermetallic compound towards boosted hydrogen evolution17
Colorful phase change material with intrinsic flexibility for personal thermal management17
A fluorine‐free MXene ‐based hydrogel membrane for oil–water separation enabling large‐scale production16
Shear‐driven process intensification: Ultrafast alkaline hydrolysis of waste PET to high‐value metal–organic frameworks16
Robust and ultrathin pore‐filling anion exchange membranes for water electrolysis16
Facet‐regulated local coordination of oxygen species on MgO for efficient cycloaddition of CO2 with propylene oxide16
SigmaFormer : Augmenting transformer encoders with COSMO sigma profiles for pure component property prediction16
Marangoni effect on hydrodynamics and mass transfer behavior in an internal loop airlift reactor under elevated pressure16
Carbon matrix anchored Rh 1 Co single‐atom alloy c16
Performance enhancement and mechanistic insights of CO 2 capture by 16
Experimental verification of the additivity between the barrel droplet's drag force and the fiber number16
Green and scalable synthesis of functionalized Al( III )‐ MOFs for 16
The effect of different solvents on the formation of large‐area MOF membranes16
Modulation of MnO bond by phosphate for boosting ozone decomposition efficiency16
Gas hydrates in future food production: A comprehensive review of the potential of an emerging technology16
A coupled kinetic‐transport model for inhibiting etherification in synthesis of polyethylene naphthalate16
Physically hybrid Zr(OH)4 + CuO catalyzed selective aniline oxidation: A new Ph‐N˙OH mediated mechanism16
Engineering sodium‐decorated bifunctional Au‐Ti sites to boost molecular transfer for propene epoxidation with H2 and O216
A novel porous liquid for enhanced CO2 uptake to improve conversion efficiency16
Capillary pumping between droplets on superhydrophobic surfaces15
Comparison of in situ and ex situ electrolytic hydrogen supply for electricity‐driven single‐cell protein production15
Closed‐loop modeling of central and intrinsic cardiac nervous system circuits underlying cardiovascular control15
Clustering in gas‐fluidized riser flows of flexible fibers15
A fluorinated phosphite enabling safe low‐concentration Li‐ion electrolytes via radical capture and weak solvation15
Issue Information ‐ Table of Contents15
Synergistic photocatalytic synthesis of H2O2: Mechanistic insights and sustainable applications15
15
15
Hydrodynamic characteristics of a novel continuous countercurrent micro‐extractor15
Mixed polymer fragment membranes on large‐area tubes for high‐performance H 2 15
Synthesis of Ni‐Al layered double hydroxide via coprecipitation: Formation mechanism, synthesis intensification, and catalytic application15
Computer‐aided ionic liquids design and molecular insight for chloromethane dehydration15
Reactive simulation of an industrial‐scale FCC reaction‐regeneration full loop system15
Hierarchically engineered electrocatalysts for durable oxygen reduction in zinc–air batteries15
Sheared settling in viscoelastic shear‐thinning fluids: Empirical studies and model development15
Anisotropic electro‐driven phase change materials inspired by biological structure15
Preface to the 2024 futures issue of AIChE Journal15
Issue Information ‐ Table of Contents15
Experimental and molecular insights on the separation of indole from wash oil by tetraethylammonium‐based ionic liquids15
Mapping the path to a net‐zero chemicals industry by long‐term planning with changes in technologies and climate15
Cold sintering of perovskite‐based mixed conducting membrane for oxygen separation15
Controlling CO / CH 4 15
Self‐adaptive copper pairs on CuO(111) boosting ammonia catalytic combustion15
Engineering global regulators for enhanced tolerance to multiple inhibitors by CRISPR ‐enabled trackable genome engineering15
Improved algebraic, numerical, and graphical representations in fluid mechanics15
Seamless scale‐up of tube‐in‐tube millireactors by annular structure and feed method design: Micromixing, residence time distribution and heat transfer15
Hierarchical porous carbon membranes for lean‐helium extraction from high‐pressure natural gas14
Mechanism of abnormal Mg 2+ extraction in sodium tetraphenylborate ‐ tributyl phosphate system for Li + 14
Fabrication of type I photoresponsive porous liquids by host surface engineering14
Direct numerical simulation of moderate‐Reynolds‐number flow past arrays of ellipsoids14
MOO ‐based implementation of process analytical technology framework: Protein refolding as a case study14
Engineering substrate reduction and product oxidation in photocatalytic NADH synthesis via interface–pore co‐confinement14
A multistep method for steady‐state Monte Carlo simulations of polymerization processes14
Distributed manufacturing for electrified chemical processes in a microgrid14
Optimal design of hydrogen‐blended natural gas pipeline network considering separation systems14
A tandem electro‐thermocatalysis platform for practical hydrogen peroxide‐mediated oxygenation reactions at high rates14
Cake formation in the filtration of associative microgel suspensions14
Enhancing deuterium/hydrogen evolution performance through synergistic effects of Ni and V2O314
Flow electrooxidation of chiral alcohols with high enantioselectivity via integrated metal‐organic frameworks and aminoxyl radicals14
In situDRIFTS examining the impact of indium doping on activity of CuIn/ZrO2 catalyst for CO2 hydrogenation to methanol14
An effective coupling for coproducing aromatics and CO‐free hydrogen in a catalytic membrane reactor14
Insight into self‐dissociation of poly(heptazine imide) nanosheets enables boosted CO2 photoreduction14
Cracking the physical insight of power law models: Bridging the gap between macroscopic kinetics and surface coverages14
A generalized zoning framework for development of CFD‐based reduced‐order compartment models14
Catalytic making of ethylene‐1‐hexene elastomers: Thermodynamic guide to process development14
Toward carbon neutrality: Single‐step polyethylene upcycling to BTX using Ni‐ZSM‐5 catalyst14
Harnessing fragmented cells as biocatalysts: The critical size for sustaining the integrity of the electron transport chain14
Tandem hydropyrolysis–hydrogenolysis of polyolefin wastes over morphology‐tuned Co 3 O 14
Phase hold‐up, axial dispersion, droplet size, and distribution of liquid–liquid flow in micropacked bed reactors14
Reaction kinetics model in liquid and solid phases and its parameterization for room temperature sodium–sulfur battery14
Adsorption‐promoted oxidation of sulfides to sulfones using TiO 2 @nitro13
Evaluation of plasma‐reaction‐driving capability in dielectric barrier discharge systems: Insights from CH 4 13
Layer‐by‐layer adhesion of hydrogels for constructing heterogeneous microfluidic chips13
Novel solvent giving well‐coordinated interactions in solvent–solute system: Synthesis and methyl mercaptan absorption13
Hierarchically porous carbon confined cobalt nanoparticles for highly efficient oxidative esterification of 5‐hydroxymethylfurfural13
Synergistic effect of hydrogen bond donors in deep eutectic solvents on separation of dimethyl carbonate/ethanol13
Reverse design of molecule‐process‐process networks: A case study from HENORC system13
Why insulin aspart and insulin degludec exhibit distinct release mechanisms13
Spanning surface interaction length scales for the design of industrial antifouling materials13
Electro‐kinetically enhanced mass transport of charged macro‐solutes through a microchannel with porous walls13
Thermoeconomic analysis of sCO2 power cycles13
Random forest models to predict the densities and surface tensions of deep eutectic solvents13
13
Issue Information ‐ Table of Contents13
Tailoring intrinsic hydrophobicity and surface energy on rough surface via low‐T Cassie–Wenzel wetting transition method13
Unveiling the interfacial polymerization for COF membranes: Real‐time monitoring of flow instability and film growth13
0.093142032623291