Submitted:
04 June 2026
Posted:
04 June 2026
You are already at the latest version
Abstract

Keywords:
1. Introduction
2. Processes
2.1. Process Descriptions
2.1.1. Process Flowsheet 1 (FS1)
2.1.2. Process Flowsheet 2 (FS2)
2.1.3. Process Flowsheet3 (FS3)
2.2. Modeling
2.3. Model Simulation and Validation
3. Steady-State Design: Optimization
3.1. Sensitivity Analysis
3.2. Objective Function
3.3. Optimization
3.4. Result and Discussion
4. Process Control
4.1. Control Structure Design
4.2. Controller Tuning
4.3. Dynamic Control Result
4.3.1. Throughput Change




4.3.2. Load Change
5. Conclusions
Author Contributions
Funding
Data Availability Statement
Abbreviations
| A | Heat transfer area of heat exchanger (ft2) |
| bhp | Brake horsepower (J s-1) |
| DC | Column diameter (ft) |
| CO2_CC | Top stream CO2 concentration controller of CO2 absorber (ppm) |
| Fd | Correction factor for equipment design type (-) |
| Fm | Correction factor for material (-) |
| Fp | Correction factor for pressure (-) |
| Fsteam | Steam flow rate of SWGSR feed (lbmol hr-1) |
| H2S_CC | Top stream H2S concentration controller of H2S absorber (ppm) |
| HP_P | Pressure of CO2 high pressure flash tank (psia) |
| KC | Gain (%/%) |
| kcos | Constant of COS hydrolysis reaction (lbmol lb-cat-1hr-1 psia-1) |
| Kcos | Equilibrium constant of COS hydrolysis reaction (psia-1) |
| Knockout CO2_CC | Top stream CO2 concentration controller of CO2 knockout drum (mole fraction) |
| kSWGS | Constant of SWGS reaction rate constant (lbmol lb-cat-1hr-1 psia-0.84) |
| KSWGS | Equilibrium constant of SWGS hydrolysis reaction (psia-0.86) |
| LC | Column length (ft) |
| L/D | Reactor aspect ratio (reactor length to diameter) (-) |
| M&S | Marshall & Swift (M&S) index |
| NA-1 | Number of H2S absorber trays |
| NA-2 | Number of CO2 absorber trays |
| NF | Stripper feed tray no. |
| NS | Number of H2S stripper trays |
| PA-1 | H2S absorber pressure (psia) |
| PA-2 | CO2 absorber pressure (psia) |
| PCO2 | Partial pressure of CO2 (psia) |
| PCOS | Partial pressure of COS (psia) |
| PCO | Partial pressure of CO (psia) |
| PH2 | Partial pressure of H2 (psia) |
| PS | H2S stripper pressure (psia) |
| Qcooler | Heat transfer duty by cooing water (Btu hr-1) |
| Qchilled | Heat transfer duty by chiller water (Btu hr-1) |
| Qele | Power (kW) |
| Qreb(H-8) | Reboiler duty (Btu hr-1) |
| Qsteam | Heat duty of steam (Btu hr-1) |
| rcos | COS hydrolysis reaction rate (lbmol lb-cat-1hr-1) |
| rSWGS | SWGS reaction rate (lbmol lb-cat-1hr-1) |
| Reflux H2S_CC | Top stream H2S concentration controller of Reflux (mole fraction) |
| S/F _CO2 | SELEXOL solvent to feed flowrate ratio of CO2 absorber |
| S/F _H2S | SELEXOL solvent to feed flowrate ratio of H2S absorber |
| Stripper _TC | Stripper temperature controller (oF) |
| SWGS_CC | SWGSR outlet H2/CO controller |
| TF | H2S stripper feed tray temperature (oF) |
| TR,out | SWGS reactor outlet temperatur (oF) |
| TH-3 | Heater outlet temperature (oF) |
| Ttray9 | The 9th tray temperature of H2S stripper (oF) |
| Greek letters | |
| λV | Latent heat of steam (Btu lb-1) |
| τI | Integral time (min) |
References
- Hammond, G. P.; Ondo Akwe, S. S.; Williams, S. Techno-economic appraisal of fossil-fuelled power generation systems with carbon dioxide capture and storage. Energy 2011, 36, 975–984. [Google Scholar] [CrossRef]
- Kunze, C.; Spliethoff, H. Modeling of an IGCC plant with carban capture for 2020. Fuel Process Technol. 2010, 91(8), 934–941. [Google Scholar] [CrossRef]
- Nataly Echevarria Huaman, R.; Jun, T.X. Energy related CO2 emissions and the progresson CCS: A review. Renew. Sustain. Energy Rev. 2014, 31, 368–385. [Google Scholar] [CrossRef]
- Wee, J. H. A review on carbon dioxide capture and storage technology using coal fly ash. Appl. Energy 2013, 106, 143–151. [Google Scholar] [CrossRef]
- Goto, K.; Yogo, K.; Higashii, T. A review of efficiency penalty in a coal-fired power plant with post-combustion CO2 capture. Appl. Energy 2013, 111, 710–720. [Google Scholar] [CrossRef]
- Li, B.; Duan, Y.; Luebke, D.; Morreale, B. Advances in CO2 capture technology: A patent review. Appl. Energy 2013, 102, 1439–1447. [Google Scholar] [CrossRef]
- National Energy Technology Laboratory. Cost and performance baseline for fossil energy power plants study. In Bituminous coal and natural gas to electricity; May 2007; Volume 1. Available online: www.netl.doe.gov.
- Rezvani, S.; Huang, Y.; Mcllveen-Wright, D.; Hewitt, N.; Mondol, J. D. Comparative assessment of coal fired IGCC systems with CO2 capture using physical absorption, membrane reactors and chemical looping. Fuel 2009, 88, 2463–2472. [Google Scholar] [CrossRef]
- Kohl, A.; Nielsen, R. Gas purification, 5th ed.; Gulf Professional Publishing: Houston, TX, 1997. [Google Scholar]
- Robinson, P. J.; Luyben, W. L. Integrated gasification combined cycle dynamic model: H2S absorption/stripping water-gas shift reactors and CO2 absorption/stripping. Ind. Eng. Chem. Res. 2010, 49, 4766–4781. [Google Scholar] [CrossRef]
- Padurean, P.; Cormos, C. C.; Agachi, P. S. Pre-combustion carbon dioxide capture by gas–liquid absorption for integrated gasification combined cycle power plants. Int. J. Greenh. Gas. Control 2012, 7, 1–11. [Google Scholar] [CrossRef]
- Bhattacharyya, D.; Turton, R.; Zitney, S. E. Steady-state simulation and optimization of an integrated gasification combined cycle power plant with CO2 capture. Ind. Eng. Chem. Res. 2011, 50, 1674–1690. [Google Scholar] [CrossRef]
- Field, R. P.; Brasington, R. Baseline flowsheet model for IGCC with carbon capture. Ind. Eng. Chem. Res. 2011, 50, 11306–11312. [Google Scholar] [CrossRef]
- Ordorica-Garcia, G.; Douglas, P.; Croiset, E.; Zheng, L. Technoeconomic evaluation of IGCC power plants for CO2 avoidance. Energy Convers. Manag. 2006, 47, 2250–2259. [Google Scholar] [CrossRef]
- National Energy Technology Laboratory. Cost and performance baseline for fossil energy power plants study: Coal to Synthetic Nature Gas and Ammonia. 2011. Available online: www.netl.doe.gov.
- Svoronos, P. D. N.; Bruno, T. J. Carbonyl sulfide: a review of its chemistry and properties. Ind. Eng. Chem. Res. 2002, 41, 5321–5336. [Google Scholar] [CrossRef]
- Lund, C. R. F. Microkinetics of water-gas shift over sulfided Mo/Al2O3 catalysts. Ind. Eng. Chem. Res. 1996, 35, 2531–2538. [Google Scholar] [CrossRef]
- Gross, J.; Sadowski, G. Perturbed-chain SAFT: an equation of state based on a perturbation theory for chain molecules. Ind. Eng. Chem. Res. 2001, 40, 1244–1260. [Google Scholar] [CrossRef]
- Xu, Y.; Schutte, R. P.; Hepler, L. G. Solubilities of carbon dioxide, hydrogen sulfide and sulfur dioxide in physical solvents. Can. J. Chem. Eng. 1992, 70, 569–573. [Google Scholar] [CrossRef]
- Douglas, J. M. Conceptual design of chemical processes; McGraw-Hill, Inc.: New York, 1988. [Google Scholar]
- Seider, W. D.; Seader, J. D.; Lewin, D. R.; Widagdo, S. Production and process design principles synthesis, analysis, and evaluation, 3rd ed.; John Wiley & Sons, Inc., 2010. [Google Scholar]
- Luyben, W. L. Plantwide dynamic simulation in chemical processing and control; Marcel Dekker, Inc.: New York, 2002. [Google Scholar]
- Tyreus, B. D.; Luyben, W. L. Tuning PI controllers for integrator/dead time processes. Ind. Eng. Chem. Res. 1992, 31, 2625–2628. [Google Scholar] [CrossRef]
- Yu, C. C. Autotuning of PID controllers; Springer: London, 1994. [Google Scholar]
- Chen, Y. H.; Yu, C. C. Interaction between thermal efficiency and dynamic controllability for heat-integrated reactors. Comput. Chem. Eng. 2000, 24, 1077–1082. [Google Scholar] [CrossRef]







| Cost($) | FS1 | FS2 | FS3 |
| SWGS/WGS | |||
| WGS reactor | $164,669.67 | $101,012.45 | $164,669.67 |
| COS reactor | $54,608.32 | $66,435.36 | $54,608.32 |
| Steam | $24,796,549.19 | $54,874,297.66 | $24,796,549.19 |
| Capital cost | $253,106.43 | $451,986.69 | $253,106.43 |
| Operating cost | $24,796,549.20 | $54,874,297.66 | $24,796,549.20 |
| H2S removal process | |||
| Absorber(A-1) | $3,595,566.6 | $1,918,995.6 | $3,213,793.7 |
| HP flash(F-1) | $922,658.4 | $697,304.1 | $825,820.5 |
| Stripper(S-1) | $708,026.2 | $444,886.8 | $607,509.7 |
| Reboiler(H-8) | $773,471.3 | $547,825.2 | $713,334.1 |
| Condenser(H-7) | $201,089.2 | $136,601.5 | $192,655.6 |
| Compressor(C-1) | $8,092,460.1 | $3,121,754.1 | $7,490,368.3 |
| Others | $7,612,538.8 | $6,312,025.2 | $6,893,098.0 |
| Steam | $10,536,664.0 | $10,596,197.9 | $8,819,547.0 |
| Cooing water | $1,825,194.2 | $1,228,477.6 | $1,732,899.1 |
| Chiller eater | $7,478,082.4 | $4,066,338.3 | $6,728,242.9 |
| Electricity | $5,701,200.1 | $1,784,334.2 | $5,188,218.3 |
| Total capital cost | $21,905,810.6 | $13,179,392.6 | $19,936,580.0 |
| Total operating cost | $25,541,140.7 | $17,675,348.0 | $22,468,907.3 |
| CO2 capture process | |||
| Absorber(A-2) | $2,236,805.8 | $2,251,354.5 | $2,400,355.3 |
| HP flash(F-2) | $1,327,392.6 | $1,331,600.0 | $1,259,435.5 |
| MP flash(F-3) | $1,175,764.0 | $1,178,966.1 | $1,113,412.8 |
| LP Flash(F-4) | $1,496,241.4 | $1,500,296.4 | $1,416,881.6 |
| Compressor(C-3) | $10,479,363.3 | $10,523,753.7 | $10,679,470.7 |
| Chiller(H-12) | $198,257.8 | $198,945.4 | $181,420.5 |
| Others | $180,534.6 | $1,829,612.4 | $295,568.2 |
| Cooling water | $65,533.3 | $1,709,146.2 | $66,014.5 |
| Chiller water | $1,593,509.7 | $2,420,504.3 | $2,534,060.1 |
| Electricity | $7,717,781.5 | $7,756,174.5 | $7,936,874.5 |
| Total capital cost | $17,094,359.4 | $18,814,528.4 | $17,346,544.4 |
| Total operating cost | $9,376,824.6 | $11,885,825.0 | $10,536,949.1 |
| Total annual cost | $98,967,790.9 | $116,881,378.3 | $95,338,636.5 |
| Controller | FS1 | FS3 | |
| SWGS_CC | Controlled variable | H2/CO=3.0 H2/CO=3.0 Steam/Feed flow Steam/Feed flow |
|
| Manipulated variable | |||
| Transmitter range | 0-6 | 0-6 | |
| Controller output range | 0-0.566 | 0-0.566 | |
| KC | 0.55 | 0.55 | |
| τI | 13.20 | 13.20 | |
| Dead time | 3 min | 3 min | |
| H2S_CC | Controlled variable | ppm H2S = 51 | ppm H2S = 46 |
| Manipulated variable | S/F_H2S | S/F_ H2S | |
| Transmitter range | 0-101 | 0-92 | |
| Controller output range | 0-0.99 | 0-0.92 | |
| KC | 0.38 | 0.22 | |
| τI | 18.48 | 21.12 | |
| Dead time | 3 min | 3 min | |
| Reflux H2S_CC | Controlled variable | mf H2S = 0.392 | mf H2S = 0.392 |
| Manipulated variable | TH-3 | TH-3 | |
| Transmitter range | 0-0.78 | 0-0.78 | |
| Controller output range | 32-258 ℉ | 32-228 ℉ | |
| KC | 1.94 | 1.97 | |
| τI | 22.44 | 22.44 | |
| Dead time | 3 min | 3 min | |
| Stripper _TC | Controlled variable | Ttray9 = 376.98 | Ttray9 = 376.98 |
| Manipulated variable | Qreb(H-8) | Qreb(H-8) | |
| Transmitter range | 32- 721 ℉ | 32- 720 ℉ | |
| Controller output range | 0-152.21 MW | 0-134 MW | |
| KC | 23.92 | 81.38 | |
| τI | 13.2 | 7.92 | |
| Lag | 1min | 1min | |
| CO2_CC | Controlled variable | mf CO2 =0.0361 | mf CO2 =0.0361 |
| Manipulated variable | S/F_CO2 | S/F_ CO2 | |
| Transmitter range | 0- 0.072 | 0- 0.07 | |
| Controller output range | 0- 6.02 | 0- 6.07 | |
| KC | 0.45 | 0.44 | |
| τI | 47.52 | 50.16 | |
| Dead time | 3 min | 3 min | |
| Knockout CO2_CC |
Controlled variable | mf CO2 = 0.9466 | mf CO2 = 0.9466 |
| Manipulated variable | HP_P | HP_P | |
| Transmitter range | 0- 1.8932 | 0- 1.90 | |
| Controller output range | 0- 667.5786 | 0- 724.65 | |
| KC | 26.38 | 50.33 | |
| τI | 62.04 | 51.48 | |
| Dead time | 3min | 3min | |
Disclaimer/Publisher’s Note: The statements, opinions and data contained in all publications are solely those of the individual author(s) and contributor(s) and not of MDPI and/or the editor(s). MDPI and/or the editor(s) disclaim responsibility for any injury to people or property resulting from any ideas, methods, instructions or products referred to in the content. |
© 2026 by the authors. Licensee MDPI, Basel, Switzerland. This article is an open access article distributed under the terms and conditions of the Creative Commons Attribution (CC BY) license (http://creativecommons.org/licenses/by/4.0/).