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Fuel
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Review article
A review of recent studies of the CFD modelling of coal gasifcation in
entrained fow gasifers, covering devolatilization, gas-phase reactions,
surface reactions, models and kinetics
Jakub Mularski
⁎
, Halina Pawlak-Kruczek, Norbert Modlinski
Department of Mechanics, Machines, Devices and Energy Processes, Faculty of Mechanical and Power Engineering, Wroclaw University of Science and Technology, Poland
ARTICLE INFO
Keywords:
CFD
Coal gasifcation
Devolatilization
Gas phase
Char conversion
Entrained fow reactor
ABSTRACT
The development and employment of comprehensive combustion/gasifcation models for the optimum selection
of process conditions and gasifcation parameters, especially for entrained fow gasifers, are still in progress.
Today many models are freely available in commercial CFD programs. Such tools have great potential as regards
the design, optimization and retroftting of gasifers. The purpose of this study was to provide an overview of the
CFD modelling of coal gasifcation, focusing on the models and kinetics of such processes as devolatilization, gas-
phase reactions and surface reactions, which have been used in CFD simulations since the year 2000. It is well
known that it is vital to correctly describe the devolatilization process in order to accurately estimate the sta-
bilization and structure of the fame, and the fnal carbon conversion. On the basis of the gas-phase chemistry,
one can correctly determine the reaction zone (fame) temperature and the local concentration of the gasifying
agents. Surface reactions are considered to be most important in evaluating gasifer performance since they are
the rate-limiting step of the process. This study reviews the latest papers on the CFD modelling of coal gasif-
cation in entrained fow gasifers, focusing on the reliability of the approaches and the kinetics of devolatili-
zation and the gas-phase and surface reactions incorporated into the model of the process. The most widely used
models are highlighted and briefy described. The most widely applied kinetic parameters of the gas phase,
devolatilization and char conversion are presented.
1. Introduction
Gasifcation is defned as the thermochemical conversion ofa
carbon-based solid fuel within diferent mediums, such as: air, O
2
,H
2
O,
CO
2
and H
2
, into a synthesis gas. Gasifcation is a chemical process
consisting of many overlapping reactions in the gas and solid phases,
which depend on the process parameters (temperature, pressure), the
fuel properties, the type of the gasifcation agents and the stoichio-
metry. The fnal products of gasifcation are a synthesis gas and ash/
slag (mineral residues). The gas consists mostly of CO and H
2
and trace
amounts of light hydrocarbons, CO
2
and N-compounds. Gasifcation is
an efcient way of raising the quality of the solid feedstock by con-
verting it into a gas fuel.
The gasifcation process can be divided into the following main sub-
processes:
a) Drying – moisture is released from the fuel and vaporized. Drying
starts at a temperature which strongly depends on the pressure
inside the reactor. For example, at the operating pressure of 1–60
bars [1] the boiling temperature of water ranges from 373 to 550 K
[2]. At lower pressures, the boiling temperature will decrease ac-
cordingly.
b) Devolatilization – the thermal decomposition of the organic material
in an oxygen-deprived atmosphere at elevated temperatures
(600–900 K) [1,3]. It consists in the breaking of the labile bonds
existing between the aromatic clusters in the feedstock. This results
in the release of light gases (volatile matter) and high molecular-
weight hydrocarbons (tar) and the formation of a carbonized re-
sidue.
c) Partial oxidation – the volatile products and some of the char react
with O
2
to form CO
2
,COandH
2
O, providing heat for the subsequent
gasifcation reactions – an autothermal process. The amount of
oxidant (either air or pure oxygen) which supports this process
ranges from 25 to 40 per cent.
d) Gasifcation/reduction- the remaining carbonized residue reacts
with CO
2
and H
2
O to produce a gas with a high CO and H
2
content –
https://doi.org/10.1016/j.fuel.2020.117620
Received 28 February 2019; Received in revised form 10 March 2020; Accepted 11 March 2020
⁎
Corresponding author. Tel.: +48 71 320 21 81.
E-mail address: jakub.mularski@pwr.edu.pl (J. Mularski).
Fuel 271 (2020) 117620
Available online 27 March 2020
0016-2361/ © 2020 Elsevier Ltd. All rights reserved.
T