Found 519 results
2022
A. N. Azri, Patel, R., Ozbuyukkaya, G., Kowall, C., Cormack, G., Proust, N., Enick, R., and Veser, G., “Batch-to-Continuous transition in the specialty chemicals Industry: Impact of operational differences on the production of dispersants”, Chemical Engineering Journal, vol. 445, p. 136775, 2022.
G. R. Wittreich, Liu, S., Dauenhauer, P. J., and Vlachos, D. G., “Catalytic resonance of ammonia synthesis by simulated dynamic ruthenium crystal strain”, Science Advances, vol. 8, p. eabl6576, 2022.
F. Gharagheizi and Sholl, D. S., “Comprehensive Assessment of the Accuracy of the Ideal Adsorbed Solution Theory for Predicting Binary Adsorption of Gas Mixtures in Porous Materials”, Industrial & Engineering Chemistry Research, vol. 61, pp. 727–739, 2022.
H. Kaur, Abedi, S., and Chen, C. - C., “Estimating CO2 Solubility in Aqueous Na+–K+–Mg2+–Ca2+–Cl––SO42– Solutions with Electrolyte NRTL–PC-SAFT Model”, Journal of Chemical & Engineering Data, 2022.
S. Jha, Glezer, A., Realff, M. J., Blaine, M. E., Mai, J., and Pearlstein, A. J., “Heat transfer enhancement in fin channels using aeroelastically fluttering reeds”, Journal of Advanced Manufacturing and Processing, vol. 4, p. e10110, 2022.
Y. Wang, Lee, S., Zhou, J., Fu, J., Foucher, A., Stach, E., Ma, L., Marinkovic, N., Ehrlich, S., Zheng, W., and Vlachos, D. G., “Higher loadings of Pt single atoms and clusters over reducible metal oxides: application to C–O bond activation”, Catalysis Science & Technology, vol. 12, pp. 2920–2928, 2022.
Y. Wang, Su, Y. - Q., Hensen, E. J. M., and Vlachos, D. G., “Insights into Supported Subnanometer Catalysts Exposed to CO via Machine-Learning-Enabled Multiscale Modeling”, Chemistry of Materials, vol. 34, pp. 1611–1619, 2022.
O. Badejo and Ierapetritou, M., “Integrating tactical planning, operational planning and scheduling using data-driven feasibility analysis”, Computers & Chemical Engineering, vol. 161, p. 107759, 2022.
P. Desir and Vlachos, D. G., “Intensified reactive extraction for the acid-catalyzed conversion of fructose to 5-hydroxymethyl furfural”, Chemical Engineering Journal, vol. 428, p. 132556, 2022.
C. J. Roos, Weber, D. J., Jang, H. Youn, and Lively, R. P., “Matching Analysis of Mixed Matrix Membranes for Organic Solvent Reverse Osmosis”, Industrial & Engineering Chemistry Research, vol. 61, pp. 3395–3411, 2022.
T. - Y. Chen, Baker-Fales, M., Goyal, H., and Vlachos, D. G., “Microwave Heating-Induced Temperature Gradients in Liquid–Liquid Biphasic Systems”, Industrial & Engineering Chemistry Research, vol. 61, pp. 3011–3022, 2022.
M. Cohen and Vlachos, D. G., “Modified Energy Span Analysis Reveals Heterogeneous Catalytic Kinetics”, Industrial & Engineering Chemistry Research, vol. 61, pp. 5117–5128, 2022.
F. Cameli, Dimitrakellis, P., Chen, T. - Y., and Vlachos, D. G., “Modular Plasma Microreactor for Intensified Hydrogen Peroxide Production”, ACS Sustainable Chemistry & Engineering, vol. 10, pp. 1829–1838, 2022.
T. Xie, Wittreich, G. R., and Vlachos, D. G., “Multiscale modeling of hydrogenolysis of ethane and propane on Ru(0001): Implications for plastics recycling”, Applied Catalysis B: Environmental, vol. 316, p. 121597, 2022.
H. Naidu, Kahraman, O., and Feng, H., “Novel applications of ultrasonic atomization in the manufacturing of fine chemicals, pharmaceuticals, and medical devices”, Ultrasonics Sonochemistry, vol. 86, p. 105984, 2022.
E. Mohammadi Shamlou, Vidic, R., and Khanna, V., “Optimization-based modeling and economic comparison of membrane distillation configurations for application in shale gas produced water treatment”, Desalination, vol. 526, p. 115513, 2022.
W. Bradley, Kim, J., Kilwein, Z., Blakely, L., Eydenberg, M., Jalvin, J., Laird, C., and Boukouvala, F., “Perspectives on the Integration between First-Principles and Data-Driven Modeling”, Computers & Chemical Engineering, p. 107898, 2022.
Y. Tian, Meduri, V., Bindlish, R., and Pistikopoulos, E. N., “A Process Intensification synthesis framework for the design of dividing wall column systems”, Computers & Chemical Engineering, vol. 160, p. 107679, 2022.
C. - H. Yu, Lin, Y. - J., Wong, D. Shan- Hill, and Chen, C. - C., “Process Modeling of CO2 Absorption with Monoethanolamine Aqueous Solutions Using Rotating Packed Beds”, Industrial & Engineering Chemistry Research, 2022.
Y. Yuan and Lobo, R. F., “Propane dehydrogenation over extra-framework In(I) in chabazite zeolites”, Chemical Science, vol. 13, pp. 2954–2964, 2022.
G. R. Wittreich and Vlachos, D. G., “Python Group Additivity (pGrAdd) software for estimating species thermochemical properties”, Computer Physics Communications, vol. 273, p. 108277, 2022.
H. Goyal, Chen, T. - Y., Chen, W., and Vlachos, D. G., “A review of microwave-assisted process intensified multiphase reactors”, Chemical Engineering Journal, vol. 430, p. 133183, 2022.
A. Baimoldina, Yang, F., Kolla, K., Altemose, P., Wang, B., Clifford, C., Kowall, C., and Li, L., “Separating Miscible Liquid–Liquid Mixtures Using Supported Ionic Liquid Membranes”, Industrial & Engineering Chemistry Research, vol. 61, pp. 747–753, 2022.
K. Lee, V. Doddapaneni, V. K., Mirzababaei, S., Pasebani, S., Chang, C. - H., and Paul, B. K., “Synthesis of a 316L stainless steel-copper composite by laser melting”, Additive Manufacturing Letters, vol. 3, p. 100058, 2022.
S. Tanveer and Chen, C. - C., “Thermodynamic analysis of hydrogel swelling in aqueous sodium chloride solutions”, Journal of Molecular Liquids, vol. 348, p. 118421, 2022.
Y. Li and Chen, C. - C., “Thermodynamic modeling of aqueous polyelectrolyte solutions with mixed-valent counterions”, The Journal of Chemical Thermodynamics, vol. 169, p. 106761, 2022.
T. Chen, Honarparvar, S., Reible, D., and Chen, C. - C., “Thermodynamic modeling of calcium carbonate scale precipitation: aqueous Na+-Ca2+-Cl–-HCO3–-CO32–-CO2 system”, Fluid Phase Equilibria, vol. 552, p. 113263, 2022.
2021
Q. Li, Wittreich, G., Wang, Y., Bhattacharjee, H., Gupta, U., and Vlachos, D. G., “Accurate Thermochemistry of Complex Lignin Structures via Density Functional Theory, Group Additivity, and Machine Learning”, ACS Sustainable Chemistry & Engineering, vol. 9, pp. 3043–3049, 2021.
V. V. K. Doddapaneni, Lee, K., Colbert, T. T., Mirzababaei, S., Paul, B. K., Pasebani, S., and Chang, C. - H., “Additive Manufacturing of Nanostructured Tungsten for Solar Thermal Applications.”, in PNWAVS symposium, Corvallis (&Virtual), 2021.
M. Palys, Hockenberry, M., Onuoha, E., McCormick, A., and Daoutidis, P., “Advances in Absorbent-Enhanced Ammonia Production”, in AIChE Annual meeting, Boston, Nov2021, 2021.
M. Inkawhich, “Advancing Zero Waste Discharge with an Integrated Solar Enabled Membrane Desalination System”, 2021.
Y. Jeng Lin, Hsieh, C. Ju, and Chen, C. Chyun, “Association-based activity coefficient model for electrolyte solutions”, AIChE Journal, 2021.
D. Shade, MounfieldIII, W. P., Huang, Y., and Marszalek, B., “An automated multi-component gas adsorption system (MC GAS)”, Review of Scientific Instruments, vol. 92, p. 054102, 2021.
D. Shade, MounfieldIII, W. P., Huang, Y., Marszalek, B., and Walton, K. S., “An automated multi-component gas adsorption system (MC GAS)”, Review of Scientific Instruments, vol. 92, p. 054102, 2021.
M. Cohen and Vlachos, D. G., “Chemical Kinetics Bayesian Inference Toolbox (CKBIT)”, Computer Physics Communications, vol. 265, 2021.
K. Cao, Son, S. Hwan, Moon, J., and Kwon, J. Sang- Il, “A closed-loop integration of scheduling and control for hydraulic fracturing using offset-free model predictive control”, Applied Energy, vol. 302, 2021.
K. Cao, Son, S. H., and Kwon, J. S., “Closed-loop integration of scheduling and offset-free model predictive control of hydraulic fracturing”, in AIChE Annual meeting, Boston, Nov 2021, 2021.
T. D. Nguyen, Zheng, W., Celik, F. E., and Tsilomelekis, G., “CO2-assisted ethane oxidative dehydrogenation over MoOx catalysts supported on reducible CeO2–TiO2”, Catalysis Science & Technology, vol. 11, pp. 5791–5801, 2021.
X. Cai, Gharagheizi, F., Bingel, L. W., Shade, D., Walton, K. S., and Sholl, D. S., “A Collection of More than 900 Gas Mixture Adsorption Experiments in Porous Materials from Literature Meta-Analysis”, Industrial & Engineering Chemistry Research, vol. 60, pp. 639–651, 2021.
X. Cai, Gharagheizi, F., Bingel, L. W., Shade, D., Walton, K. S., and Sholl, D. S., “A Collection of More than 900 Gas Mixture Adsorption Experiments in Porous Materials from Literature Meta-Analysis”, Industrial & Engineering Chemistry Research, vol. 60, pp. 639–651, 2021.
M. Jebur, Chiao, Y. - H., Thomas, K., Patra, T., Cao, Y., Lee, K., Gleason, N., Qian, X., Hu, Y., Malmali, M., and S. Wickramasinghe, R., “Combined electrocoagulation-microfiltration-membrane distillation for treatment of hydraulic fracturing produced water”, Desalination, vol. 500, p. 114886, 2021.
I. - M. Hsieh, Thakur, A. K., and Malmali, M., “Comparative analysis of various pretreatments to mitigate fouling and scaling in membrane distillation”, Desalination, vol. 509, p. 115046, 2021.
M. S. Monjur, Demirel, S. E., Li, J., and Hasan, M. F., “A Computer-Aided Platform for Simultaneous Process Synthesis and Intensification”, in 31st European Symposium on Computer Aided Process Engineering, 2021.
D. Shade, Marszalek, B., and Walton, K. S., “Correction to: Structural similarity, synthesis, and adsorption properties of aluminum-based metal-organic frameworks”, Adsorption, vol. 27, 2021.
Y. Wei Hsiao, Anastasopoulou, A., Ierapetritou, M., and Vlachos, D. G., “Cost and energy efficient cyclic separation of 5-hydroxymethyl furfural from an aqueous solution”, Green Chemistry, vol. 23, pp. 4008–4023, 2021.
Y. Wei Hsiao, Anastasopoulou, A., Ierapetritou, M., and Vlachos, D. G., “Cost and energy efficient cyclic separation of 5-hydroxymethyl furfural from an aqueous solution”, Green Chemistry, vol. 23, pp. 4008–4023, 2021.
V. V. K. Doddapaneni, Lee, K., Mirzababaei, S., Paul, B. K., Pasebani, S., AuYeung, N., and Chang, C. - H., “Digital Fabrication of Nanostructured Metal Oxide Coatings on Silica Sand-Microstructure and Thermal and Optical Properties”, in 50th National Solar Conference: ASES Solar, Boulder (&Virtual), 2021.
C. Mevawala, Bai, X., Bhattacharyya, D., and Hu, J., “Dynamic Data Reconciliation, Parameter Estimation, and Multi-Scale, Multi-Physics Modeling of the Microwave-Assisted Methane Dehydroaromatization Process”, Chemical Engineering Science, vol. 239, p. 116624, 2021.
C. Mevawala, Bai, X., Bhattacharyya, D., and Hu, J., “Dynamic Data Reconciliation, Parameter Estimation, and Multi-Scale, Multi-Physics Modeling of the Microwave-Assisted Methane Dehydroaromatization Process”, Chemical Engineering Science, vol. 239, p. 116624, 2021.