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Inherently Safer Design of A Reactor Network System A Case Study
Inherently Safer Design of A Reactor Network System A Case Study
A B S T R A C T
The strategies of Inherently Safer Design (ISD) provide a conceptual approach in order to design equipment and
processes with substantially improved safety level. However, this may lead to a less economically attractive
design. This study aimed to obtain optimal decision parameters of a reactor network system to produce allyl
chloride. The objective functions were the risk level, including the severity and the frequency of the accidents,
which were associated with the hazards in the network and the economic profit of the process. Based on this
optimization approach, an array of optimal solutions (called Pareto front) was obtained as a trade-off between
the objectives under investigation. A final design point was ultimately selected using Shannon's entropy and
Bellman-Zadeh's techniques of decision making in a fuzzy environment. Results showed that the optimum re-
actor network leads to a highly complex system and more process control difficulties. This result was inconsistent
with the simplification strategy of Inherently Safer design. In order to deal with this problem, a sensitivity
analysis was performed that yielded a decision guide to decide about the desirable level of the risk as well as the
optimum design.
∗
Corresponding author. Center for Process Design, Safety and Loss Prevention (CPSL), Department of Chemical and Petroleum Engineering, Sharif University of Technology, Azadi
Tehran, Iran.
E-mail address: eini_saeed@che.sharif.edu (S. Eini).
https://doi.org/10.1016/j.jlp.2017.12.004
Received 22 June 2017; Received in revised form 8 December 2017; Accepted 8 December 2017
Available online 09 December 2017
0950-4230/ © 2017 Elsevier Ltd. All rights reserved.
S. Eini et al. Journal of Loss Prevention in the Process Industries 51 (2018) 112–124
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S. Eini et al. Journal of Loss Prevention in the Process Industries 51 (2018) 112–124
Table 2
Studies on the inherent safety based on the consequence modeling.
Shariff et al. (2006) Subject Evaluation the consequence of VCE to assess the level of inherent safety among different designs at initial simulation
stages
Approach Developing a demonstrative tool called “integrated Risk Estimation Tool” (iRET).
Tools Process simulation using HYSYS
Consequence modeling developed in MS Excel
Case study Piping leak from liquefied natural gas (LNG) plant
The effect of introducing the inert (steam) on explosion risk acrylic acid production
Determining preliminary layout of the plant concurrently with process design.
Considered Hazards VCE
Considered Strategies Moderation
Shariff and Zaini (2010) Subject development of a prototype tool for consequence analysis and design improvement via inherent safety principle
Approach Developing a tool called “Toxic release consequence analysis tool” (TORCAT)
Tools The consequence analysis based on the worst-case scenarios
Case study identify potential hazards from selected streams for a purification column in a typical ammonia production plant
Considered Hazards Toxic Release
Considered Strategies Moderation
Intensification
Patel et al. (2010) Subject Inherently safer design of solvent processes at the conceptual
Stage
Approach Integrating consequence modeling into process simulation to evaluate the safe distance as a measure of inherent safety for
different design alternatives
Tools Aspen plus simulator
ICAS 11.0-ProCAMD (Computer Aided Molecular Design software) consequence modeling (Using regulatory guidance
from EPA RMP)
Case study Liquid extraction of acetic acid-water mixture
Considered Hazards VCE
Considered Strategies Intensification
Moderation
Substitution
Medina-Herrera et al. (2014) Subject Development of inherently safer distillation systems
Approach using principles of quantitative risk analysis together with economic objectives
Tools ASPEN Plus process simulator
A toolkit developed in MATLAB to calculate societal and individual risk and cost
Case study This case study considers a mixture of hydrocarbons, n-hexane/n-heptane, to be separated by distillation
Benzene-toluene mixture that must be separated by distillation
Considered Hazards Jet fire
Flash Fire
BLEVE
VCE
Flash Fire
Toxic release
Considered Strategies Intensification
Moderation
Simplification
Eini et al. (2015) Subject Developing an optimization procedure to select inherently safer design Scheme
Approach Optimization of an objective function that includes processing costs and accident costs
Tools Aspen HYSYS Process simulator
A toolkit (integrated with simulator) developed in MATLAB to model the consequences and evaluate processing costs
Case study Simple refrigeration cycle
Considered Hazards BLEVE/Fireball
Considered Strategies Intensification
Substitution
Moderation
Eini et al. (2016a) Subject Multi-Objective formulation in order to inherently safer design of a simple refrigeration cycle
Approach Optimization of total annual cost and risk level simultaneously
Tools Aspen HYSYS Process simulator
A toolkit (integrated with simulator) developed in MATLAB in order to model the consequences, assess accident
frequencies, and evaluate total annual cost
Case study Simple refrigeration cycle
Considered Hazards BLEVE/Fireball
Considered Strategies Intensification
Moderation
Eini et al. (2016b) Subject Multi-Objective formulation in order to inherently safer design of a simple refrigeration cycle
Approach Optimization of total cost rate (considering environmental penalty), exergy efficiency, and risk level simultaneously
Tools Aspen HYSYS Process simulator
A toolkit (integrated with simulator) developed in MATLAB in order to evaluate risk level, total annual cost,
environmental damages, and exergy efficiency
Case study Cascade refrigeration cycle
Considered Hazards Toxicity/BLEVEa/VCEb/VCFc/Jet Fire
Considered Strategies Intensification
Substitution
Moderation
a
Boiling Liquid Expanding Vapor Explosion
b
Vapor Cloud Explosion
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S. Eini et al. Journal of Loss Prevention in the Process Industries 51 (2018) 112–124
c
Vapor Cloud Fire
• Risk level
Eini et al. (2016b) • Total cost rate NSGA-II a
18
Chlorine + Propene → Allyl Chloride + Hydrogen Sulphide
16
8
Chlorine + Propene → 1,2 Dichloropropene
6
These reactions could be mathematically represented by the non-
isothermal Van de Vusse reaction scheme that involves four species. 4
The consecutive reaction:
2
k1 k2
A→B⎯→
⎯ C 0
0 100 200 300 400 500 600 700 800 900 1000
And the parallel reaction: Temperature (C)
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S. Eini et al. Journal of Loss Prevention in the Process Industries 51 (2018) 112–124
mass inventory in the reactors in this study, only reactors were con- Table 4
sidered as the release sources. Frequency data (LNE, 2009).
In the present study, several potential damage receptors were con-
Loss of equipment event Frequency (year−1)
sidered as follows:
Catastrophic rupture 5E-05
• 10 people in the distance of 20 m away from the hazards source. Large breach 2.2 E −03
• 30 people in the distance of 200 m away from the hazards source. Medium breach 2.2 E −03
• 350 people in the distance of 4000 m away from the hazards source.
• A building (B4-Type according to API definition (API, 1995)) at a In order to specify the leakage frequency, frequency databanks such
distance of 300 m downwind that had 20 occupants. as OGP (2010) and handbook of failure frequencies (LNE, 2009) can be
used that are quite common. Table 4 displays some generic frequency
In this study, the individual risk (IR) was used as a measure of the data for pressure vessels (LNE, 2009).
risk. Individual risk produced by an accident can be calculated using
Equation (2):
3.2.1.1. Probability of immediate ignition. As it is shown in Fig. 4, after a
IRi = fi × Ci (2) release, the outcome can be different depending on either the presence
or the absence of an immediate ignition source. Presence of an
where:
immediate ignition source will lead to the formation of a BLEVE/
Fireball (Mannan, 2012).
IRi : outcome risk of accident "i" ,
Moosemiller (2011) proposed an equation in terms of the auto ig-
fi : frequency of occurence of accident "i",
nition temperature (TAuto ignition ), the ambient temperature (T), operation
Ci : consequence of accident "i".
pressure (P) and the Minimum Ignition Energy (MIE) (Equation (5)).
Where TAuto ignition and T are in degrees Fahrenheit, P is in psig, and
The risk associated with reactor “r” (IRr) was determined using
MIE is in mJ.
Equation (3), in which all of the possible accidents are summed for
reactor “r”: ⎛ −9.5 ⎛ ⎜
T ⎞⎞
⎟
⎡ P3 ⎤
1
Pimm.ignition = 1 − 5000e ⎝ TAuto ignition ⎠ + ⎢0.0024 × 2⎥
m ⎜ ⎟
⎠ ⎣ MIE 3⎦ (5)
IRr = ∑ IRi ⎝
i= 1 (3)
In this equation “m” refers to total number of possible accidents. 3.2.1.2. Probability of delayed ignition. When ignition does not occur
immediately, and there is sufficient time to form a vapor cloud, a
3.2.1. Frequency estimation delayed ignition may happen. Table 5 shows the probability of delayed
Considering the frequency of a release as the initiating event, Event ignition for various ignition sources (Uijt de Haag and Ale, 1999).
Tree was used for calculating the frequency of different possible out- Because this study was conducted during R&D phase and conse-
comes. Multivariable mathematical event tree based on the theory of quently detailed information of the plant layout was not presented, the
accidents occurrence, the data from the past events, and the expert delayed ignition probability was conservatively considered to be equal
judgment were all integrated in order to provide a comprehensive to 0.5.
model for estimation of frequency (Javidi et al., 2015). Upon a flam-
mable and toxic chemicals' catastrophic rupture, these outputs could be: 3.2.1.3. Probability of VCE rather than VCF. Upon presence of a delayed
Vapor Cloud Explosion (VCE), Vapor Cloud Fire (VCF or Flash Fire), ignition source, two different outcomes may happen: VCE or VCF. In a
Boiling Liquid Expanding Vapor Explosion (BLEVE) and toxic release. congested area or release of significant amount of flammable gas, a VCE
Fig. 4 shows a typical Event Tree developed for a flammable and toxic is more probable to happen. The probability of occurrence of VCE can
vapor release (Medina-Herrera et al., 2014). be determined in terms of the released mas using Equation (6)
By multiplying the initial event frequency by the probabilities of (Bernechea and Viger, 2013):
occurrence in each branch, the frequency of the final events can be
PVCE = 0.024 m0.435 (6)
calculated in Event Tree. For example, Equation (4) shows how the
frequency of a VCE as a final outcome of the event tree can be calcu-
lated according to the event tree that is shown in Fig. 4. 3.2.2. Consequence modeling
For the catastrophic release, consequence analysis involves quanti-
f VCE = frupture × Pdelayed ignition × (1 − Pimm.ignition) × PVCE (4)
fication of the released mass and the effects/damages. In this study,
−1
In this equation, frupture is rupture frequency in year . Also, human life damages and structure damages were considered as im-
Pdelayed ignition and Pimm.ignition are the probabilities of delayed ignition and portant factors to be evaluated. Table 6 shows outcomes presented in
of immediate ignition, respectively. PVCE shows the probability of the Fig. 4 and their associated effects:
occurrence of VCE rather than VCF. For these outcomes, a detailed procedure to model the consequences
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n
Table 5
Probability of delayed ignition in one minute for various ignition sources (Uijt de Haag IIR = ∑ Cnnf × Pnf × (IRnf )
and Ale, 1999). nf = 1 (9)
BLEVE/Fireball Thermal radiation Pnf : The probability of occurrence of this accident as independent
Blast wave
VCE Blast wave
accidents and is calculated as below:
VCF Thermal radiation 1 nf
Pnf = ⎛ ⎞
TOXIC Toxic dispersion ⎝n⎠ (11)
In the reactor network under study, different reactors have different
and the approach to estimate the related physical effects has been properties (such as volume, flammable material inventory, toxic ma-
presented by (Medina-Herrera et al., 2014; Eini et al., 2015, 2016a, terial inventory, and fluid composition). Consequently each reactor has
2016b). A Probit model is used to calculate the damage effects on its own risk level that may differ from the others. In this paper, an
human and buildings of all outcomes. Probit methods provide a gen- average risk (IRavg) is defined that can be assigned to each reactor. IRavg
eralized time dependent function, which could be used for toxic, is calculated by averaging the risks of all of the reactors in the network
thermal and blast effects (Medina-Herrera et al., 2014). (Equation (12)):
Cost of each outcome (BLEVE, VCE, VCF, or toxic) is the summation N
∑r= 1 IRr
of all of the cost damage, including human life fatality, human injuries, IR avg =
N (12)
building collapse and major building damage. The cost of the major
building damage is considered to be 70 present of the cost of the In Equation (12) N is the total number of reactor in the network and
building collapse. IRr is individual risk of r-th reactor. Finally the IR nf can be calculated
using Equation (13):
4
Ck = ∑ Costi IR nf = nf * IR avg (13)
i= 1 (7)
Costi : The cost of the damages (human life fatality, human injuries, In this study, process profit was another important objective func-
building collapse and building major damage) tion, which was expected to be maximized. This function is defined as
Ci : The cost of outcome “i” the total sales of products and byproducts subtracting from the expenses
such as raw material, reactor costs, utility cost and final separation cost.
Table 7 shows the cost data that have been used in the consequence This function can be shown as Equation (14).
modeling (Eini et al., 2015).
f VCE = frupture × Pdelayed ignition × (1 − Pimm.ignition) × PVCE (14)
The cost data are presented in Table 8 (Pahor et al., 2001).
3.2.3. Integrated individual risk calculation
The working time for the plant was supposed to be 8000 h/year. The
Rearranging Equation (3), the risk calculated for a reactor (as a
investment costs of a reactor and final separation were calculated using
hazard source) can be represented as below:
Equations (15) and (16), respectively (Pahor et al., 2001):
IRr = (fBLEVE*CBLEVE) + (f VCE*CVCE) + (fVCF *CVCF) + (fToxic*CToxic) (8)
Reactor cost ⎛ $ year ⎞ = 4200 × V 0.63
The reactor network shown in Fig. 2 consists of several reactors in ⎝ ⎠ (15)
series and parallel. Hence, it is possible that a number of reactors suffer where
from the similar event at the same time. Therefore, the general equation
V: Reactor volume (m3)
that determines the total risk of network should be expanded to con-
sider all of the probability of the accident scenario combinations to
obtain the realistic results. The Integrated Individual Risk (IIR), as the Final separation cost ⎛ $ year ⎞ = 105 × F
⎝ ⎠ (16)
overall risk level of the plant, which is one of the objective functions,
can be expressed as Equation (9) (Bernechea and Viger, 2013): Table 8
Component and utility costs (Pahor et al., 2001).
Table 7
Cost data (Eini et al., 2015). Component/utility Cost
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It should be noted that the cost calculation was performed in 2016 Fij
Fnij = n
prices. Chemical Engineering Plant Cost Index (CEPCI) for 2001 and ∑i= 1 F2ij (17)
2016 were 394.3 and 536.4, respectively.
Table 9
Shannon Entropy is calculated as below:
Specified NSGA-II options for multi-objective optimization. n
1
SEj = −
ln(n)
∑ Pijln(Pij)
Specified Options Value i= 1 (20)
Population Size 30 Next step is to calculate deviation degree (dj), which shows that to
Maximum Generation 300
what extent jth objective has useful information for decision making.
Tournament Size 2
Crossover Function Intermediate Deviation degree is given by:
Crossover Probability 0.9
dj = 1 − SEj (21)
Mutation Function Constraint Dependent
Mutation Probability 0.1
Pareto Fraction 0.6 Then the weight of jth objective can be obtained based on following
equation:
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S. Eini et al. Journal of Loss Prevention in the Process Industries 51 (2018) 112–124
point on the Pareto frontier was the point in which each objective was ⎪
1 if Fj (x) ≤ Fmin
j (33)
⎩
optimized regardless of the satisfaction of other objectives. On the other
hand, the non-ideal point was the point in the objectives' space in which
each objective had its worst value. Then, for the selection of the final • Fuzzy constraints are formulated as follows:
solution from Pareto frontier, the distance of each solution from ideal Gi (x) ≤ Gmax
i + di , i = 1,2, …, k (34)
point (di +) and non-ideal point (di −) must have been calculated sepa-
di is a subjective parameter that denotes a distance of allowable dis-
rately. Finally, the solution with minimum (di +) and maximum (di −)
placement for the bound of the jth restriction. Corresponding mem-
was chosen as finial optimum solution.
bership functions are defined using the subsequent procedure:
3.4.3.2. Bellman-Zadeh's decision making method. When applying ⎧ 0 if Gj (x) > Gmax
j
Bellman-Zadeh's approach (Arora et al., 2016), each objective ⎪ Gi (x) − Gmax
μ Gj (x) = 1 − i if G j < Gj (x) ≤ Gmax
max
j + di
function of optimization problem was exchanged by a fuzzy objective ⎨ di
function: ⎪ 1 if Gj (x) ≤ Gmax
j (35)
⎩
Ai = {x.μ Ai} x∈ L , i = 1,2, …, k (24)
where μ Ai is a membership function of ith fuzzy objective function.
• Final decision is determined by the intersection of all fuzzy re-
strictions and criteria, which are accessible by means of membership
Then, fuzzy objective functions are combined to form a decision, D, functions. This problem can be reduced to the standard nonlinear
which is a fuzzy set resulted from intersection of Ai : programming problems to discover x and k values which maximize
D(x) = ∩ki= 1 Ai (x) = mini= 1,2, … , k Ai (x) (25) k and subject as follows:
And consequently, the membership function of the intersection is λ≤μ Fj , j=1,2, …, k λ≤μ Gi , i=1,2, …, n (36)
specified by:
The solution of the multi-criteria problem discloses the meaning of
μ D (x) = ∩ki= 1 μ Ai (x) = mini= 1,2, … , k μ Ai (x) (26) the optimality operator and depends on the decision-makers’ experi-
ence and understanding of the problem.
Its use permits us to attain a solution providing the maximum de-
gree of belongingness to the fuzzy solution D:
3.4.4. Integrated procedure for MOOF
max D(x) = maxx∈L mini= 1,2, … , k Ai (x) (27) Fig. 6 displays the illustrative procedure of the integrated metho-
dology, which was utilized in this study. In the first step, the super-
max μ D (x) = maxx∈L mini= 1,2, … , k μ Ai (x) (28) structure was simulated in a process simulator (ASPEN HYSYS). Risk
And reducing the above-mentioned problem leads to a search for: level and plant processing costs formulation were codified in MATLAB
as well as the MOO algorithm. The optimizer algorithm determined and
X0 = arg maxx∈L mini= 1,2, … , k μ Ai (x) (29) sent the decision variable to the simulator to complete a design. The
To obtain the above-mentioned equation output, it is necessary to evaluation variables (such as flow, density, etc.) were extracted from
create membership function, μ Ai , i = 1, 2 … k, of objective functions, Fi the simulator in order to calculate the corresponded value of the ob-
(x), i = 1, 2 … k. The membership function of the objectives, either jective functions. At the second step, all non-dominated solutions
linear or nonlinear, can be designated depending on the context of (Pareto frontier) were generated by using evolutionary algorithm pro-
problem. One of possible fuzzy convolution schemes is offered below: cedure based on the NSGA-II. At the last step, final optimal points were
chosen using Shannon's entropy and Bellman-Zadeh’ fuzzy decision
• The matrix table T, which has the diagonal elements of ‘‘ideal’’ making methods. Also, in this part, the deviation index of each solution
from the ideal and non-ideal solutions is evaluated to explore the rea-
points, is defined as follows:
sonable status of various solutions obtained in dual-objective optimi-
0 0
⎡ F1 (x1) ⋯ Fn (x1) ⎤ zation and single objective optimization.
{T} = ⎢ ⋮ ⋱ ⋮ ⎥
⎢ 0 0 ⎥
⎣ F1 (x n) ⋯ Fn (x n) ⎦ (30) 3.4.4.1. Objective function, decision variables and constraints
• maximum and minimum limits for the criteria can be defined as A mathematical model of the optimization problem has three main
parts: the objective functions, the decision variables and the constraints
follows:
problem. Two objective functions were used for this study including:
Fmax
j = maxiFi (x0i ) j= 1, …, n i= 1, …, k maximizing economic profit of the plant and minimizing risk level as a
Fmin = mini Fi (x0i ) j= 1, …, n i= 1, …, k measure of inherent safety level of the process. The mathematical for-
j (31)
mulations of objective functions are as follows (based on Section 3.2
• The membership functions are assumed for all fuzzy goals as fol-
and 3.3):
• Risk level:
lows:
• For maximization problem
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n
reactors were chosen based on discussions presented in Section 3.1. The
IIR = ∑ c nnf × Pnf × (IRnf )
bounds for the reactors volume and the number of the parallel branches
nf = 1 (37)
might vary from case to case. However, increasing the number of the
• Plant Profit:
parallel branches made the plant more complex.
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S. Eini et al. Journal of Loss Prevention in the Process Industries 51 (2018) 112–124
1000 methods are less compared with deviation indexes (0.503 and 0.497) in
single objective optimization. Therefore, the final optimal solution se-
Nadir solution B
900 lected by Shannon's entropy decision makings is most preferred, be-
cause it shows the minimum deviation index from ideal solution in
optimization procedure. The last row of Table 10 represents the nu-
800
merical values of optimum decision variables, which corresponded to
Risk Level (US $/year)
m 2 m 2
dideal = ∑ j= 1 (Fj − Fideal
j ) , dnadir = ∑ j= 1 (Fj − Fnadir
j ) 5. Conclusion
(43b)
Deviation index of optimal solution obtained by Shannon's entropy In the present study, a reactor network system was modeled to
and Fuzzy method with single optimization approach are presented in produce allyl chloride. Moreover, this system was analyzed from both
last column of Table 10. Shannon's entropy decision making method inherent safety and economic viewpoints. Employing genetic algorithm
yields lower value of deviation index as 0.176 with dual objective op- technique, the multi-objective optimization of the system was per-
timization. Moreover, deviation indices (0.176 and 0.179) obtained in formed to obtain the optimum design parameters of the system with
dual objective optimization with the above-mentioned decision making regard to both inherent safety and economics. The risk posed by the
Table 10
Comparison between optimal solutions for dual-objective and single-objective optimizations.
Optimum design variables and objective functions based on Shannon entropy decision making
16 0.04 375.4 3.7 1.00 – – 0.20 391.8 3.9 3.24 × 107 US $ 428.8 US $ year−1
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S. Eini et al. Journal of Loss Prevention in the Process Industries 51 (2018) 112–124
Table 11
Comparison of optimization results for five different cases.
X1 1 2 3 4 5
X2 0.02 0.02 1.00 0.02 0.05
X3 376.9 368.8 – 335.6 355.1
X4 5.6 5.1 – 3.6 2.9
X5 0.82 0.75 0.01 0.95 0.73
X6 316.5 329.8 201.4 338.2 390.7
X7 3.6 2.8 3.4 3.3 1.7
X8 0.17 0.11 1.00 0.23 0.00
X9 366.9 350.4 – 356.7 403.3
X10 4.1 3.9 – 4.1 3.2
Processing profit (US $ year−1) 1.23 × 107 1.79 × 107 1.39 × 107 2.29 × 107 2.45 × 107
Change in the processing profit compared with the optimal case of Table 10 −62% −45% −57% −29% −24%
Risk level (US $ year−1) 707.86 660.07 285.46 622.27 614.12
Change in the risk level compared with the optimal case of Table 10 +65% +54% −33% +45% +43%
hazards in the network (considering both consequences and frequencies Methodologies. Springer, US, pp. 273–316.
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