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A R T I C L E I N F O A B S T R A C T
Keywords: Computational fluid dynamic (CFD) simulations were performed to assess the potential chlorine leak scenario in
Toxic gas the super-urban area of South Korea, where the human population density is very high and numerous buildings
Dispersion exist near operational water treatment facilities. Flame acceleration simulator (FLACS) was used to predict the
Computational fluid dynamic (CFD)
consequence from accidental chlorine releases out of one of the water treatment facilities for the nearby area
Chlorine
Geometry
having a size of 5 km × 3 km approximately. The ability to precisely implement 3-D geometries is crucial for a
Human fatality rates successful 3-D simulation. Thus, a method was proposed to rapidly and accurately implement geometry by
Physical barrier importing computer aided-design (CAD) files provided by a government agency, and processing them using Auto
CAD and MicroStation software programs. An accidental release from an 18-ton tank was simulated with three
different wind directions to determine the expected evacuation distances. Results from the study showed that the
endpoint distances varied depending on the density and arrangement of the buildings. Moreover, we employed
physical barriers with varying heights for mitigating the effects of toxic gas releases and simulated how effec
tively they decreased the concentration of released chlorine.
* Corresponding author.
** Corresponding author.
E-mail addresses: lovesme@ajou.ac.kr (M. Min), bogussoft@ajou.ac.kr (J. Park), safetyfirst@hknu.ac.kr (C. Kang), processsafety@ajou.ac.kr (S. Jung).
https://doi.org/10.1016/j.jlp.2020.104337
Received 31 July 2020; Received in revised form 22 October 2020; Accepted 24 October 2020
Available online 2 November 2020
0950-4230/© 2020 Elsevier Ltd. All rights reserved.
M. Min et al. Journal of Loss Prevention in the Process Industries 69 (2021) 104337
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M. Min et al. Journal of Loss Prevention in the Process Industries 69 (2021) 104337
chemical reaction occurring when the toxic gas and the river met did not
affect the toxic gas release or dispersion. The 3-D geometry of the (5)
building used in the present study is shown in Fig. 1.
Since the main wind direction of Seoul city is northwesterly wind,
When there is a wall or obstacle near the boundary of the flow field,
and most chemicals are characterized by rapid dispersion along the main
the turbulence kinetic energy or dispersion rate changes rapidly to show
wind direction after being released, the geometry was implemented
the highest value. The viscous force of the plane closest to the wall
mainly in the south-east direction from the facility selected for the
surface is dominated by the inertial effect. The function of the wall is
release of the gas.
used to model the effect on the wall on some points at certain distances
from the wall.
2.3. Model for the numerical analysis
A dimensionless wall distance is defined by:
The FLACS uses a governing equation for compressive flows with a ρ∁1/4 1/2
μ k y
logical structure to apply the finite volume method to the three- y += (6)
μ
dimensional Cartesian coordinate system to derive the results. In addi
tion, it uses the k-ε model for turbulence behavior analysis. where, y is the distance from the point on the wall to the next wall, and
Transport equation for turbulent kinetic energy: the point on the wall was defined as the point near the wall where the
∂ ∂ ( ) ∂
(
μeff ∂k
) transfer equation can be solved.
(βv ρk) + β j ρu j k = βj + βv pk − βv ρε (1)
∂t ∂xj ∂xj σk ∂xj
2.4. Using a grid to assess the structural analysis in the gas release
Transport equation for the dissipation rate of turbulent kinetic
simulations
energy:
( )
∂ ∂ ( ) ∂ μeff ∂ε ε2 A mesh is necessary for structural analysis in gas release simulations.
(βv ρε) + βj ρuj ε = βj + β v pε − C 2 ε β v ρ (2) In the FLACS, however, the analysis is conducted with the concept of a
∂t ∂xj ∂xj σε ∂xj k
grid instead of a mesh. The accuracy of the simulation strongly depends
*βv : Volume porosity. on diverse simulation parameters, being of particular importance the
The turbulence could be analyzed with the k-ε model and the eddy grid resolution (Schleder et al., 2014). Thus, more dense grids are
viscosity model, which uses two transfer equations for turbulent kinetic created at locations that require more accurate analysis. In the present
energy and the dissipation of turbulent kinetic energy. study, grids were densely created at the point where the gas was released
Following the Boussinesq eddy viscosity assumption, an eddy vis and in the surrounding areas. However, they were loosely created at
cosity could be used to model the Reynolds stress tensor as follows: areas that were relatively far away from the foregoing point. The
( ) detailed information is shown in Table 1 and Figs. 2–4. Table 2 shows
′u ′ ∂ui ∂uj 2 the details of three scenarios.
− ρui j = μeff + − ρ kδij (3)
∂xj ∂xi 3
The constants used in the modeling of the Reynolds stress tensor are 2.5. Assumptions and scenarios
as follows. (Launder and Spalding, 1983).
The duration and flow rate of toxic gas release are the main variables
(4) that determine the dispersion range when a toxic gas is released. We
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M. Min et al. Journal of Loss Prevention in the Process Industries 69 (2021) 104337
Table 2 high rates because it will be trapped in the obstacle and will have to go
Three scenarios used for the simulation chlorine release. around the obstacles which are mainly buildings. As a result, the toxic
Scenario 1 Scenario 2 Scenario 3 gas dispersion rate and stay-time are expected to be much different.
Therefore, in the present study, preliminary simulations were carried
Leak size (hole diameter) 10 cm 10 cm 10 cm
Tank pressure 100 psig 100 psig 100 psig out to compare the toxic gas dispersion patterns with geographic fea
Temperature 25 ◦ C 25 ◦ C 25 ◦ C tures. Accordingly, a total of three scenarios were assumed: (a) chlorine
Release rate 225 kg/s 225 kg/s 225 kg/s release in the northerly direction, which had the shortest endpoint dis
Total mass release 18,000 kg 18,000 kg 18,000 kg tance, (b) chlorine release in the westerly direction with the longest
Weather condition Class F Class F Class F
Wind speed 1.5 m/s 1.5 m/s 1.5 m/s
endpoint distance, (c) chlorine release in the northwesterly direction,
Main wind direction NW 310◦ W 270◦ N 360◦ which is the main wind direction of Seoul.
On the other hand, chlorine toxicity is well known and its toxic
concentration for inhaling threshold for emergency evacuation is 3 ppm
as used US EPA(Environmental Protection Agency), Korean NCIS well as
assumed a toxic gas release of 180,00 kg chlorine from the facility. In the in this paper for the endpoint distance concentration. ERPG 1,2,3 con
present study, it was assumed that the entire 18,000 kg of chlorine centrations are 1, 3, 10 ppm respectively and their definitions are as
would be released due to an accident as worst case scenario. Not only follows in the box;
accident but also a terrorist attack can be a cause of release. A release Where, US EPA is defined for ERPG 1 and ERPG 2 as follows.
rate of 225 kg/s, as used by Hanna et al. (2009), was adopted for a
comparison reason. In other words, it was assumed that a total of 18000 • ERPG 1: maximum airborne concentration below which it is believed
kg of chlorine would be released over 80 s at a rate of 225 kg/s. There are nearly all individuals could be exposed up to 1 h without experi
some assumptions behind such as. encing other than mild transient adverse health effects or perceiving
a clearly defined objectionable odor
• The hole in the tank assumed to be circle with diameter 4inch and • ERPG 2 is the maximum airborne concentration below which it is
tank pressure assumed to be 100 psig, tank and ambient tempera believed nearly all individuals could be exposed up to 1 h without
tures are assumed to be 25 ◦ C experiencing or developing irreversible or other serious health ef
• Liquid chlorine got discharged once the leak hole is made fects that could impair their abilities to take protective action.
• Pool boiling would occur right after the discharge which would make
the discharged liquid chlorine become gas 3. Results and discussion
• To maintain the leak rate as 225 kg/s, there is no varying discharge
rate(kg/s) 3.1. Dispersion results
Atmospheric stability grade F and a wind speed of 1.5 m/s, which are The results of the simulations on the dispersion of released chlorine
used as the worst case scenario (weather) for dispersion in terms of the gas showed that the endpoint distance of toxic gas are along the main
endpoint distance defined by the National Institute of Chemical Safety wind direction, as shown in Fig. 5, which was consistent with the
(NICS), were used. When a toxic gas is accidentally released, it is ex assumption set at the beginning of the study. Also, from Table 3, it was
pected to escape quickly along the main wind direction, and if there is an observed that the endpoint distance and the arrival time of the toxic gas
obstacle, such as a building, the toxic gas will not be able to escape at differed according to the wind directions. This is because the chlorine
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M. Min et al. Journal of Loss Prevention in the Process Industries 69 (2021) 104337
gas was dispersed rapidly in the Han River basin, which was represented In addition, the present study identified differences in the speed and
by an empty space in the geometry and, all layouts are different each trapping of toxic gas released from the downtown area when the gas
other as reflected the real city. When wind blows from North, the passed through the concentrated area of buildings, as well as when the
dispersion is hindered and gas can be contained in between buildings. gas passed through terrain with no building. This enabled finding not
That’s why the endpoint distance for scenario 3 is the shortest compared only the endpoint arrival distances of toxic gases but also the exposure
to other scenarios. times of areas located between buildings. Therefore, the findings of the
These results were consistent with findings of previous studies, present study were expected to provide more realistic information for
which indicated that building geometry affect urban air quality in CFD the prediction of and preparation for the risks of toxic gas release and
simulations (Kwak et al., 2015). These results are important and should dispersion in cases where a facility is operated in areas where apart
be referred to when urban emergency response plans are established. ments and buildings are concentrated in the neighborhood.
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M. Min et al. Journal of Loss Prevention in the Process Industries 69 (2021) 104337
Fig. 5. FLACS CFD results from scenario 1 (northwest wind), scenario 2 (west wind), and scenario 3 (north wind), where 1 ppm contours are shown at 30 s.
( )
Table 3 erf (probit − 5)
Pdeath = 0.5 + 1 + √̅̅̅ (9)
ERPG-2 (3 ppm) endpoint distances and the arrival times of each scenario. 2
*ERPG: Emergency Response Planning Guideline.
∫x
End point distance End point distance arrival time 2
erf(x) = √̅̅̅⋅ e − t2 dt (10)
Scenario 1 2323 m 500 s π
0
Scenario 2 3136 m 970 s
Scenario 3 1370 m 710 s
Where c is the concentration of toxic gas (ppm), t is the time, and a,b,
and n are parameters that depend on the gas involved, and values for
3.2. Human fatality rate chlorine are as followings; a: 15.6 b: 1 n:2.
As limitation, the concentrations and fatality rates are for people
The endpoint distances seem very far (max. 3.1 km) and it is almost outdoor not indoor in the paper for purpose of simplicity.
impossible to evacuate people inside the impacted zone which may have Fig. 6 shows the result of simulation of gas release using the formula
over a half million people. This would make the emergency plan very above, when the gas was released according to scenario 1 used in the
ineffective, and unrealistic. The first responder or planner for emergency present study, and was examined at a height of 1.5 m, which is the
situation should seek a better way to save people in the case of release. height of the nose of humans. From this figure, the fatality probability
Therefore urgent evacuation zone prediction using fatality rate instead was found to have reached 37% in just 29 s after the chlorine gas release
of endpoint distance is suggested. The fatality probability from toxic gas was started and the distance would go up to 100 m. 0.1% fatality rate
release depending on the concentration of the gas and the time of release reaches 0.9 km from the source in Scenario 1 and it is the distance to
could be calculated. The FLACS followed the formula as follows to need more attention for evacuation.
calculate the probability (Gexcon, 2017).
( ) ∫t 3.3. Mitigation
Tdose mg/m3 ⋅ minute = cn dt (7)
0 As shown in the simulation results, when a toxic gas is released near
the downtown area, the gas can cause great damage to the nearby areas
Probit = a + b ln(Tdose ) (8)
and residents. Therefore, reduction measures that could minimize the
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M. Min et al. Journal of Loss Prevention in the Process Industries 69 (2021) 104337
influence of the toxic gas are necessary. In the present study, 3 m, 6 m, Table 5, the effectiveness seem very obvious that the higher wall, the
and 9 m high barriers were installed at a distance of 100 m from the better safety measures. And it is more effective in the vicinity of leak
release source, as shown in Fig. 7, to examine the reduction effects point, which suggests that this safety measures can more effectively
through differences in concentrations at the same point as compared work in the nearby locations. In addition, using fatality rate instead of
with that at the scenarios where there was no wall. This 3, 6, 9 m ERPG-2 would help the contingency plan more precisely when having
physical walls have been used in Goldfish experiments(1986) and other those physical walls for mitigation in the facility.
CFD simulations (Lim et al., 2017).
Fig. 8 is a graph that shows changes in concentrations at different 4. Conclusions
barrier heights and distances from barriers. Tables 4 and 5 show some
areas of chlorine concentrations with different barrier heights and dis In order to implement many buildings in a short time, Auto CAD and
tances from the barrier as well as the efficiency of concentration MicroStation, which are not conventional methods for FLACS, were
reduction according to different barrier heights.where CNo,x : concen proposed and used to generate the geometry. Thereafter, with a view to
tration without barrier at x meter. consider the effects of obstacles & wind directions in a mega city like
Cy,x : concentration of y meter barrier at x meter. Seoul, which was replicated identically to the actual geometry helped by
From Table 4, the concentrations decrease quickly in the vicinity of GIS, CFD simulations were carried out. As a result, differences in the
the leak point, but it doesn’t seem that effective in the far-field. From speed and time of the released toxic gas between when the gas passed
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M. Min et al. Journal of Loss Prevention in the Process Industries 69 (2021) 104337
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M. Min et al. Journal of Loss Prevention in the Process Industries 69 (2021) 104337
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