Publications

If you wish to add publications to this list, please contact Jane Engel (jane.engel@netl.doe.gov) to help keep this publications list, and the corresponding EndNote library, synchronized. Thank you!

Singh, R. K., Galvin J. E., & Sun X. (2017).  Hydrodynamics of the rivulet flow over corrugated sheet used in structured. International Journal of Greenhouse Gas Control. 64, 87-98.
Singh, R. K., Galvin J. E., Whyatt G. A., & Sun X. (2017).  Breakup of a liquid rivulet falling over an inclined plate: Identification of a critical. Physics of fluids. 29(5), 
Ma, J., Eason J., Dowling A. W., Biegler L. T., & Miller D. C. (2016).  Development of a First-Principles Hybrid Boiler Model for Oxy-Combustion Power Generation System. International Journal of Greenhouse Gas Control. 46, 136-157.
Miller, D. C., Litynski J. T., Brickett L. A., & Morreale B. D. (2016).  Toward transformational carbon capture systems. AIChE Journal. 62, 2-10.
Singh, R., Galvin J. E., & Sun X. (2016).  Three-dimensional simulation of rivulet and film flows over an inclined plate: Effects of solvent properties and contact angle. Chemical Engineering Science. 142, 244-257.
K. Bhat, S., Mebane D. S., Storlie C. B., & Mahapatra P. (2015).  Upscaling Uncertainty with Dynamic Discrepancy for a Multi-scale Carbon Capture System. Journal of American Statistical Association.
Chen, Y., Eslick J. C., Grossmann I. E., & Miller D. C. (2015).  Simultaneous process optimization and heat integration based on rigorous process simulations. Computers & Chemical Engineering. 81, 180-199.
Chen, Y., Grossmann I. E., & Miller D. C. (2015).  Computational Strategies for Large-Scale MILP Transshipment Models for Heat Exchanger Network Synthesis. Computers & Chemical Engineering. 82, 68-83.
Cozad, A., Sahinidis N., & Miller D. C. (2015).  A combined first-principles and data-driven approach to model building. Computers & Chemical Engineering. 73, 116–127.
Dowling, A. W., Balwani C., Gao Q., & Biegler L. T. (2015).  Optimization of Sub-Ambient Separation Systems with Embedded Cubic Equation of State Thermodynamic Models and Complementarity Constraints. Computers & Chemical Engineering. 81, 323–343.
Dowling, A. W., & Biegler L. T. (2015).  A framework for efficient large scale equation-oriented flowsheet optimization. Computers & Chemical Engineering. 72, 3-10.
Lai, C., Xu Z., Pan W., Sun X., Storlie C. B., Marcy P. W., et al. (2015).  Hierarchical Calibration and Validation of Computational Fluid Dynamics Models for Solid Sorbent-based Carbon Capture. Powder Technology. 288, 388–406.
Li, T. (2015).  Validation of a 2.5D CFD model for cylindrical gas‐solids fluidized beds. Chemical Engineering Science. 286, 817–827.
Li, T., Benyahia S., Dietiker J., Musser J., & Sun X. (2015).  A 2.5D computational method to simulate cylindrical fluidized beds. Chemical Engineering Science. 123, 236-246.
Miller, D. C., Sun X., Storlie C. B., & Bhattacharyya D. (2015).  Using Advanced Modeling to Accelerate the Scale-Up of Carbon Capture Technologies. Power Engineering. 119,
Morgan, J. C., Bhattacharyya D., Tong C., & Miller D. C. (2015).  Uncertainty Quantification of Property Models: Methodology and Its Application to CO2-Loaded Aqueous MEA Solutions. AIChE Journal. 61, 1822-1839.
Wong, R. K. W., Storlie C. B., & Lee T. C. M. (2015).  A Frequentist Approach to Computer Model Calibration. Journal of Royal Statistical Society B.
Yu, M., Miller D. C., & Biegler L. T. (2015).  Dynamic Reduced Order Models for Simulating Bubbling Fluidized Bed Adsorbers. Industrial & Engineering Chemistry Research. 54, 6959-6974.
Cozad, A., Sahinidis N., & Miller D. C. (2014).  Learning Surrogate Models for Simulation-Based Optimization. AIChE Journal. 60, 2211-2227.
Dowling, A. W., Balwani C., Gao Q., & Biegler L. T. (2014).  Equation-Oriented Optimization of Cryogenic Systems for Coal Oxycombustion Power Generation. Energy Procedia. 63, 421-430.
Dowling, A. W., Eason J., Ma J., Miller D. C., & Biegler L. T. (2014).  Coal Oxycombustion Power Plant Optimization using First Principles and Surrogate Boiler Models. Energy Procedia. 63, 352-361.
Eslick, J. C., Ng B., Gao Q., Tong C. H., Sahinidis N. V., & Miller D. C. (2014).  A framework for optimization and quantification of uncertainty and sensitivity for developing carbon capture systems. Energy Procedia. 63, 1055-1063.
Holloway, W., & Sundaresan S. (2014).  Filtered models for bidisperse gas-particle flows. Chemical Engineering Science. 108, 67-86.
Konomi, B. A., Karagiannis G., & Lin G. (2014).  On the Bayesian treed multivariate Gaussian process with linear model of coregionalization. Journal of Statistical Planning and Inference. 157-158, 1-15.
Konomi, B. A., Karagiannis G., Sarkar A., Sun X., & Lin G. (2014).  Bayesian Treed Multivariate Gaussian Process with Adaptive Design; Application to a Carbon Capture Unit. Technometrics. 56, 145-158.
Lane, W. A. (2014).  Numerical Modeling and Uncertainty Quantification of a Bubbling Bed with Immerersed Horizontal Tubes. Powder Technology. 253, 733-743.
Mahapatra, P., Ma J., Ng B., Bhattacharyya D., Zitney S. E., & Miller D. C. (2014).  Integrated Dynamic Modeling and Advanced Process Control of Carbon Capture Systems. Energy Procedia. 63, 1354–1367.
Miller, D. C., Syamlal M., Mebane D. S., Storlie C. B., Bhattacharyya D., Sahinidis N., et al. (2014).  Carbon Capture Simulation Initiative: A Case Study in Multiscale Modeling and New Challenges. Chemical and Biomolecular Engineering. 5, 301-323.
Sarkar, A., Pan W., Suh DM., E. Huckaby D., & Sun X. (2014).  Multiphase flow simulations of a moving fluidized bed regenerator in a carbon capture unit. Powder Technology. 265, 35-46.
Sarkar, A., Sun X., & Sundaresan S. (2014).  Verification of sub-grid filtered drag models for gas-particle fluidized beds with immersed cylinder arrays. Chemical Engineering Science. 114, 144-154.
Sherman, B., Frailie P., Li L., Salta N., & Rochelle G. T. (2014).  Thermodynamic and Kinetic Modeling of Piperazine/2-Methylpiperazine. Energy Procedia. 63, 1243-1255.
Storlie, C. B., Lane W. A., Ryan E. M., Gattiker J. R., & Higdon D. M. (2014).  Calibration of Computational Models with Categorical Parameters and Correlated Outputs via Bayesian Smoothing Spline ANOVA. Journal of the American Statistical Association. 110, 68-82.
Xu, W., DeCroix D. S., & Sun X. (2014).  Mechanistic based DEM simulation of particle attrition in a jet cup. Powder Technology. 253, 385-392.
Agarwal, K., Sharma P., Ma J., Lo C., Gorton I., & Yan L. (2013).  REVEAL: An Extensible Reduced Order Model Builder for Simulation and Modeling. Computing in Science and Engineering. 16, 44-53.
Agrawal, K., Holloway W., Milioli C. C., Milioli F. E., & Sundaresan S. (2013).  Filtered models for scalar transport in gas–particle flows. Chemical Engineering Science. 95, 291-300.
Dowling, A. W., & Biegler L. T. (2013).  Optimization-based process synthesis for sustainable power generation. Chemical Engineering Transactions. 35, 1-12.
Mebane, D. S., K. Bhat S., Kress J. D., Fauth D. J., Gray MM. L., Lee A., et al. (2013).  Bayesian calibration of thermodynamic models for the uptake of CO2 in supported amine sorbents using ab initio priors. Physical Chemistry Chemical Physics. 15, 4355-4366.
Mebane, D. S., Kress J. D., Storlie C. B., Fauth D. J., Gray MM. L., & Li K. (2013).  Transport, Zwitterions, and the Role of Water for CO2 Adsorption in Mesoporous Silica-Supported Amine Sorbents. The Journal of Physical Chemistry C. 117, 26617-26627.
Milioli, C. C., Milioli F. E., Holloway W., Agrawal K., & Sundaresan S. (2013).  Filtered two fluid models of fluidized gas-particle flows: New constitutive relations. AIChE Journal. 59, 3265-3275.
Modekurti, S., Bhattacharyya D., & Zitney S. E. (2013).  Dynamic Modeling and Control Studies of a Two-Stage Bubbling Fluidized Bed Adsorber-Reactor for Solid–Sorbent CO2 Capture. Industrial & Engineering Chemistry Research. 52, 10250–10260.
Monazam, E. R., Shadle L. J., Miller D. C., Pennline H. W., Fauth D. J., Hoffman J. S., et al. (2013).  Equilibrium and Kinetics Analysis of Carbon Dioxide Capture using Immobilized Amine on a Mesoporous Silica. AIChE Journal. 59, 923-935.
Ryan, E. M., DeCroix D. S., Breault R., Xu W., E. Huckaby D., Saha K., et al. (2013).  Multi-phase CFD modeling of solid sorbent carbon capture system. Powder Technology. 242, 117-134.
Sarkar, A., Sun X., & Sundaresan S. (2013).  Sub-grid drag models for horizontal cylinder arrays immersed in gas-particle multiphase flows. Chemical Engineering Science. 104, 399-412.
Lee, A., & Miller D. C. (2012).  A One-Dimensional (1-D) Three-Region Model for a Bubbling Fluidized-Bed Adsorber. Industrial & Engineering Chemistry Research. 52, 469-484.
Eslick, J. C., & Miller D. C. (2011).  A multi-objective analysis for the retrofit of a pulverized coal power plant with a CO2 capture and compression process. Computers & Chemical Engineering. 35, 1488-1500.
Miller, D. C., Eslick J. C., Lee A., & Morinelly J. E. (2011).  A Modular Framework for the Analysis and Optimization of Power Generation Systems with CCS. Energy Procedia. 4, 2082-2089.
Zitney, S. E. (2010).  Process/equipment co-simulation for design and analysis of advanced energy systems. Computers & Chemical Engineering. 34, 1532-1542.