Contents

CHEM E 485 Process Design I

-★- Chemical Processes Design

Aspen Plus Unit Operations

  • Mixers/Splitters

    • Mixer - Mixes 1+ inlets to 1/2 outlet streams. The second outlet is the decant stream based on density.
    • SSplit - Splits flow based on only two outlet parameters (split fraction, flow)
    • FSplit - Splits flow based on many outlet parameters (split fraction, flow, limit flow, cumulative flow)
      • Cannot specify outlet conditions, homogeneously mixed
  • Separators

    • Flash - Used for flash drums, evaporators, single-stage separators
      • Cannot specify outlet conditions, determined by thermodynamics
      • Flash2 - Separates feed into 2 outlets (VLE)
      • Flash3 - Separates feed into 3 outlets (VLLE)
    • Decanter - Liquid-liquid separation
    • Separator - Used for single-stage distillation and absorption with known inlet and outlet conditions
      • Need to specify outlet conditions
      • Sep - Separates feed into 2+ outlets
      • Sep2 - Separates feed into 2 outlets
  • Exchangers

    • Heater
    • HeatX
    • MHeatX
  • Columns

    • Shortcut columns - Used for rapid estimation
      • Assume constant molar overflow and constant relative volatility between light and heavy keys
      • DSTWU - Winn-Underwood Gilliland method
        • Fenske (Winn) equation determines min number of stages $N_{\min}$ and optimum feed location $N_{F, \min}$ at total reflex condition
        • Underwood equation determines the min reflux ratio $(L/D)_{\min}$
        • Gilliland correlation determines the actual number of stages $N$ and feed location $N_F$ at actual reflex ratio $L/D$
      • Distl - Edmister’s method
        • Requires design specification or simulation data from DSTWU
          • Actual number of stages $N$, feed location $N_F$, reflex ratio $L/D$, distillate to feed molar ratio $D/F$, condenser type, and operating pressures of condenser and reboiler
    • Rigorous columns - Used for rigorous simulation
      • Can perform detailed design of column iternals: geometries, hydraulics, packings etc.
      • RadFrac - Used for absorption, stripping, distillation (extractive, azeotropic, reactive)
      • Extract - Used for ternary liquid-liquid extraction
        • Requires thermal specification and stage-wise pressure profile
    • Crude/Petroleum
      • MultiFrac, SCFrac, PetroFrac, ConSep
  • Reactors

    • Balance/Stoichiometry-based
      • RStoic - Models given stoichiometry and conversion (extent of reaction) but unknown kinetics and sizing
      • RYield - Models given stoichiometry and yield but unknown kinetics and sizing
        • Satisfies total mass balance, but not component balance (may not satisfy 1st law of thermo)
    • Equilibrium-based
      • REquil - Models reversible reaction assuming max conversion at chemical and phase equilibrium
        • Requires separate liquid and vapor outlets
      • RGibbs - Models chemical equilibrium with minimum $G$ of outlet mixture without given reaction
        • Follows 1st law of thermo
    • Kinetic model-based
      • RCSTR
      • RPlus
      • RBatch

Source: Aspen Plus Simulation Software (NPTEL, Indian Institute of Technology, Guwahati)

Ch 1 Design Process

  • Block flow diagram (BFD)

    • Blocks represent unit operations
    • Blocks connected by inputs and outputs with arrows
    • Flow goes from left to right in general
    • Light stream toward top, heavy stream toward bottom
    • Critical info presented (important $T, P$, conversion, yield, chemical reaction)
    • If lines cross, horizontal line is continuous, vertical line broken
    • Simplified material balance provided
  • Process flow diagram (PFD)

    • Process topology

      • Process topology - location of and interaction between equipment and process stream

      • Major equipment represented by icons with unique equipment number and descriptive name

      • All streams identified by stream number

      • All utility streams supplied to major equipment provided

      • Basic control loops with important control strategy shown

      • Naming convention: process equipments
        • Abbreviations
          • V - Vessel
          • P - Pump
          • E - Heat exchanger
          • H - Fire heaters
          • R - Reactor
          • C - Turbines/Compressors (trapezoid, shape relative to process stream flow)
          • T - Towers
          • TK - Storage tanks
        • Equipment numbering
          • XX-YBB A/B
            • XX - equipment abbreviation
            • Y - unit number (could be a subunit of a larger plant/process)
            • BB - equipment number of the unit
            • A/B - built in degeneracy (spare equipment) for important locations
      • Non-significant equipment replacement inherits equipment name and number

      • Significant equipment change uses new equipment name and number

    • Stream information

      • Stream number identified in a diamond box

      • Stream direction identified by arrow

      • Naming convention: utility streams

        Electrical component is not shown on PFD as utility streams

        • lps - Low-Pressure Steam: 3–5 barg (sat)*
        • mps - Medium-Pressure Steam: 10–15 barg (sat)*
        • hps - High-Pressure Steam: 40–50 barg (sat)*
        • htm - Heat Transfer Media (Organic): to 400°C
        • cw - Cooling Water: From Cooling Tower 30°C Returned at Less than 45°C
        • wr - River Water: From River 25°C Returned at Less than 35°C
        • rw - Refrigerated Water: In at 5°C Returned at Less than 15°C
        • rb - Refrigerated Brine: In at −45°C Returned at Less than 0°C
        • cs - Chemical Wastewater with High COD
        • ss - Sanitary Wastewater with High BOD, etc.
        • el - Electric Heat (Specify 220, 440, 660V Service)
        • bfw - Boiler Feed Water
        • ng - Natural Gas
        • fg - Fuel Gas
        • fo - Fuel Oil
        • fw - Fire Water
      • Stream flow summary

        • Requires: Stream number, temperature, pressure, vapor fraction, total mass flow rate, total mole flow rate, component mole flow rates
        • Optional: Component mole fraction, component mass fraction, component mass flow rate, volumetric flow rates, significant physical properties, thermodynamic data, stream name
      • Stream identification symbols (stream flag) shows info critical for safety

    • Equipment information

      • Equipment descriptions used for estimate equipment purchase cost
      • Towers: Size (height and diameter), pressure, temperature, number and type of trays, height and type of packing, materials of construction
      • Heat Exchangers
        • Type: Gas-Gas, Gas-Liquid, Liquid-Liquid, Condenser, Vaporizer
        • Process: Duty, Area, Temperature, and Pressure for Both Streams
        • Number of Shell and Tube Passes
        • Materials of Construction: Tubes and Shell
      • Tanks and Vessels: Height, Diameter, Orientation, Pressure, Temperature, Materials of Construction
      • Pumps: Flow, Discharge Pressure, Temperature, ΔP, Driver Type, Shaft Power, Materials of Construction
      • Compressors: Actual Inlet Flowrate, Temperature, Pressure Inlet and Outlet, Driver Type, Shaft Power, Materials of Construction
      • Heaters (Fired): Type, Tube Pressure, Tube Temperature, Duty, Fuel, Material of Construction
      • Other: Provide Critical Information
  • Piping and instrumentation diagram (P&ID)

Ch 2 Structure and Synthesis of Process Flow Diagrams

  • Hierarchy of design process

    • Decide batch/continuous
    • Identify input/output
    • Identify and define recycle
    • Identify and design separation
    • Identify and design heat exchanger or energy recovery system
  • Batch/continuous

    • Batch process - finite quantity of product is made during a time period
    • Continuous process - feed is continuously sent to equipment; outputs continuously sent to storage or further processing
    • Pilot plant is important to gain insight into full-scale operations
      Factor Batch Continuous
      Size ➕ Small throughput <500 ton/yr ➕ Large throughput > 5000 ton/yr (economy of scale)
      Product quality/batch accountability ➕ When product quality must be verified and certified (pharm and food) ➕ When off-spec material could be blended or stored and reworked
      ➖ Could produce large quantities of off-spec product
      Operational flexibility ➕ Same equipment can be used for multiple operations ➖ Inefficient use of idle units
      ➖ Need retrofitting of plants if demand changes
      Standardized equipment - multiple products ➕ Same equipment can produce different products ➖ Same equipment can only produce designed products
      Processing efficiency ➖ Require strict scheduling
      ➖ Energy integration not possible - more utility usage
      ➖ Difficulty separation and recycle
      ➕ Efficiency increases with throughput
      ➕ Recycle is easy
      Maintenance and operating labor ➖ Higher operating labor cost (cleaning, preparation) ➕ Lower operating labor cost
      Feedstock availability ➕ When availability is limited/seasonal ➕ When needed in large quantity throughout the year ➖ Seasonal feed need to be stored
      Product demand ➕ When demand is seasonal ➖ Difficult to make other products during off-season
      Rate of reaction to produce products ➕ When reaction rate is slow and need high residence times ➕ When reaction rate is high and need less residence time
      Equipment fouling ➕ When equipment fouling is significant ➖ Fouling is harder to handle
      Safety ➖ Worker exposure to chemicals
      ➖ Higher operator error
      ➕ Established safety procedure and record
      ➕ Less risk with handling chemicals
      Controllability ➖ Controllability is difficulty and complicated ➕ Easier to control
  • Input/output

    • Process concept diagram
      • Reactions, side reactions, reactants, products, byproducts
    • Block flow diagram
      • Reactor feed prep, reactor, separator feed prep, separator, recycle, environmental control
    • Process flow diagram
      • Input not consumed in reactor must operate equipment or pass through the process as inerts
      • Outputs must have entered from feed or be produced from reactions
      • Utility streams provide heat or work and do not contact process stream
    • Heuristics
      • Do not separate trace inert impurities before feeding
      • Do not separate impurities before feeding if difficult
      • Purify feed if impurities foul or poison catalyst
      • Purify feed if impurities react to form hard-to-separate or hazardous product
      • Purify feed if impurities is in large quantity
  • Recycle

    • Raw material cost is ~25-75% total operating cost
    • ➕ Higher overall conversion, reduce raw material cost
    • ➕ Less waste processing
    • ➕ Less environmental impact
    • ➖ Bigger equipment (larger flow rate)
    • ➖ More equipment (more separation steps)
      Description Equation Heuristics
      Single-pass conversion $\small\dfrac{\text{Reactant consumed in reaction}}{\text{Reactant fed to reactor}}$ $\downarrow$ single-pass conversion,
      $\uparrow$ recycle flow rate
      Overall conversion $\small\dfrac{\text{Reactant consumed in process}}{\text{Reactant fed to reactor}}$ $\uparrow$ overall conversion,
      $\downarrow$ raw material loss
      Yield $\small\dfrac{\text{Moles of reactant to produce desired product}}{\text{Moles of limiting reactant reacted}}$ $\uparrow$ yield,
      $\downarrow$ side reaction loss
    • Recycle types
      • Separate feed from product then recycle
        • If separation is easy
      • Recycle feed and product together, with purge stream
        • If not eqm reaction, cannot react further, or inert (avoid accumulation)
      • Recycle feed and product together, no purge stream
        • If eqm reaction, or can react further in reactor

Ch 3 Batch Processing

  • Batch processing is unsteady state
  • Gantt charts - tables that illustrate a series of tasks (rows) that occur over period of time (columns)
  • Flowshop plant - all products use the same equipment in the same sequence, but not the same length of time
  • Jobshop plant - not all products use the same equipment or used in the same sequence
Description Equation
Total time of non-overlapping operations $t_{NO} = n\sum t_i$
Total time of overlapping operations $t_O = (n - 1) \max (t_i)+ \sum t_i$
Cycle time of non-overlapping operations $t_{\text{cycle}, NO} = \dfrac{t_{NO}}{n} = \sum t_i$
Cycle time of overlapping operations $t_{\text{cycle}, O} = \dfrac{t_O}{n} = \dfrac{1}{n}[(n - 1) \max (t_i)+ \sum t_i]$
Cycle time of overlapping operations
★ $n \to \infty$
$t_{\text{cycle}, O} \approx \max(t_i)$
Total processing (production cycle) time of flowshop plant
★ $n > 20$
$t = \displaystyle\sum_j n_j(t_{\text{cycle}})_j \approx \sum_j n_j[\max(t_i)]_j$

Ch 4 Chemical Product Design

  • Commodity chemical - manufactured by many companies in large quantity (usually continuous)
  • Specialty chemical - made in smaller quantities (usually batch), usually by inventer company
  • Product design strategies: needs, ideas, selection, manufacture

Ch 5 Tracing Chemicals through PFD

  • Mixer - two or more input streams are combined to form a single stream
  • Splitter - a single input stream is split into two or more output streams
    • Same $T, P, x_i, y_i$, Different $\dot{m}, \dot{n}, \dot{V}$
  • Primary chemicals - species identified in the overall block flow diagram with chemical reaction
  • Primary flow paths - path followed by primary chemicals between reactor and the boundaries of process
  • Only reactors converts reactant to product
  • Recycle loop - stream in a loop flow so that the flow path forms a complete circuit back to the point of origin
  • Bypass stream - streams in a loop flow so that the flow path does not form a complete circuit back to the place of origin

Ch 6 Process Conditions

  • The ability to make an economic analysis of a chemical process on a PFD is not proof that the process will actually work
  • Stream $T, P, x_i, and y_i$ should be adjusted to process condition before fed into the unit
    • Changing $T, P$ is easier than $x_i, y_i$
  • $P \in [1, 10] \ \mathrm{bar}$
    • $P > 10 \ \mathrm{bar}$ - High pressure needs thicker wall, more expensive equipment
    • $P < 1 \ \mathrm{bar}$ - Vaccum conditions needs larger equipment with special construction technique
  • $T \in [40, 260] ^\circ \mathrm{C}$
    • $T < 40 ^\circ \mathrm{C}$ - lowest $T$ for water cooling. Cryogenic condition needs expensive construction material and refrigerant
    • $T > 260 ^\circ \mathrm{C}$ - highest $T$ for steam heating. Combustion heater needed
    • $T > 400 ^\circ \mathrm{C}$ - highest $T$ for stainless steeel to have no loss in tensile strength. Equipment needs expensive alloys and refractory-lined

-★- ChemE Economic Analysis

Ch 7 Estimation of Capital Costs

  • Classifications of capital cost estimates

    • Economics - evaluation of capital costs and operating costs associated with construction and operation of a chemical process
    • Capital cost - costs of construction of a new plant or modification to an existing plant
    Name Diagrams Level of project definition Purpose Method Expected accuracy index Preparation effort index
    Order-of-magnitude estimate
    (Ratio/feasibility estimate)
    BFD 0 - 2 % Screening or feasibility Stochastic or judgement 4 - 20 1
    (Lowest)
    [0.015%, 0.300%] total plant cost
    Study estimate
    (Major equipment/factored estimate)
    PFD 1 - 15 % Concept study or feasibility Primarily stochastic 3 - 12 2 - 4
    Preliminary estimate
    (Scope estimate)
    PFD 10 - 40 % Budget, authorization, or control Mixed but primarily stochastic 2 - 6 3 - 10
    Definitive estimate
    (Project control estimate)
    PFD, P&ID 30 - 70 % Control or bid/tender Primarily deterministic 1 - 3 5 - 20
    Detailed estimate
    (Firm/Contractor’s estimate)
    PFD, P&ID 50 - 100 % Check estimate or bid/tender Deterministic 1
    (Highest^)
    [-4%, +6%]
    10 - 100
  • Estimation of equipment costs

    • Equipment cost attribute (capacity) - equipment parameter used to correlate capital costs
    • Six-tenth rule - equipment without known cost exponent $n$ can be estimated with $n = 0.6$
      • Economy of scale - Larger equipment has lower cost of equipment per unit capacity
      • $n < 1$
    • Cost index
      • Marshall and Swift process industry index
      • Chemical engieering plant cvost index (CEPCI)
    Description Equation
    Capacity and cost
    $n \in [0.4, 0.8]$
    $\dfrac{C_2}{C_1} = \left(\dfrac{A_2}{A_1}\right)^n$
    Time and cost $\dfrac{C_2}{C_1} = \dfrac{I_2}{I_1}$
    Time and capacity adjustments $\dfrac{C_2}{C_1} = \left(\dfrac{A_2}{A_1}\right)^n \left(\dfrac{I_2}{I_1}\right)$
  • Estimating total capital cost

    • Total module cost $C_{\text{TM}} = C_{\text{BM}}^\circ + C_{\text{Cont}} + C_{\text{Fee}}$
      • Bare module cost $C_{\text{BM}}^\circ = C_{\text{DE}} + C_{\text{IDE}}$
        • Direct project expenses $C_{\text{DE}} = C_p + C_M + C_L$
          • Equipment free on board (f.o.b.) cost $C_p$ - purchased cost of equipment at manufacturer’s site
          • Materials required for installation $C_M$ - piping, insulation, fireproofing, foundations, structural support, instrumentation, electrical, painting
          • Labor to install equipment and material $C_L$
        • Indirect project expenses $C_{\text{IDE}} = C_{\text{FIT}} + C_O + C_E$
          • Freight insurance and taxes $C_{\text{FIT}}$ - transportation, insurance, and tax cost for shipping equipment to plant site
          • Construction overhead $C_O$ - fringe benefit (vacation, sick leave, retirement benefits), labor burden (social security, unemployment insurance), salary and overhead for supervisory personnel
          • Contractor engineering expenses $C_E$ - salary and overhead for engineering, drafting, and project management personnel
      • Contingency $C_{\text{Cont}}$ - covers unforeseen circumstances: loss of time from weather and strikes, small change in design, unpredicted price increase
      • Contractor fee $C_{\text{Fee}}$
    • Auxiliary facility
      • Site development $C_{\text{Site}}$ - purchase of land; grading and excavation of site; installation and hookup of electrical, water, and sewer system; construction of all internal roads, walkways, and parking lots
      • Auxiliary buildings $C_{\text{Aux}}$ - administration offices, maintenance shope, control rooms, warehouses, service buildings (cafeteria, dressing rooms, medical facilities)
      • Off-sites and utilities $C_{\text{Off}}$ - raw material and final product storage and loading/unloading facility; equipment for process utility; central environmental control facility; fire protection system
    Level 5 cost Level 4 cost Level 3 cost Level 2 cost Level 1 cost Definition Expression in terms of $C_p^\circ$
    Grassroot cost - - - - $C_{GR} = C_{\text{TM}} + C_{\text{Aux}}$
    | Total module cost - - - $\begin{aligned}C_{\text{TM}} = C_{\text{BM}}^\circ + C_{\text{Cont}} + C_{\text{Fee}}\end{aligned}$ $\begin{aligned}=C_p^\circ (1 + \alpha_M)(1 + \alpha_L + \alpha_{\text{FIT}} + \alpha_L \alpha_O + \alpha_E)(1 + \alpha_{\text{Cont}} + \alpha_{\text{Fee}})\end{aligned}$
    | | Bare module cost - - $C_{\text{BM}}^\circ = C_{\text{DE}} + C_{\text{IDE}}$ $=C_p^\circ (1 + \alpha_M)(1 + \alpha_L + \alpha_{\text{FIT}} + \alpha_L \alpha_O + \alpha_E)$
    | | | Direct project expenses - $C_{\text{DE}} = C_p^\circ + C_M + C_L$ $=C_p^\circ (1 + \alpha_M)(1 + \alpha_L)$
    | | | | Equipment $C_p^\circ = C_p^\circ$ $=C_p^\circ$
    | | | | Materials $C_M = \alpha_M C_p^\circ$ $=C_p^\circ \alpha_M$
    | | | | Labor $C_L = \alpha_L (C_p^\circ + C_M)$ $=C_p^\circ (1 + \alpha_M)\alpha_L$
    | | | Indirect project expenses - $C_{\text{IDE}} = C_{\text{FIT}} + C_O + C_E$ $=C_p^\circ (1 + \alpha_M)(\alpha_{\text{FIT}} + \alpha_L \alpha_O + \alpha_E)$
    | | | | Freight $C_{\text{FIT}} = \alpha_{\text{FIT}} (C_p^\circ + C_M)$ $=C_p^\circ (1 + \alpha_M)\alpha_{\text{FIT}}$
    | | | | Overhead $C_O = \alpha_O C_L$ $=C_p^\circ (1 + \alpha_M)\alpha_L \alpha_O$
    | | | | Engineering $C_E = \alpha_E (C_p^\circ + C_M)$ $=C_p^\circ (1 + \alpha_M)\alpha_E$
    | | Contingency - - $C_{\text{Cont}} = \alpha_{\text{Cont}}C_{\text{BM}}^\circ$ $=C_p^\circ (1 + \alpha_M)(1 + \alpha_L + \alpha_{\text{FIT}} + \alpha_L \alpha_O + \alpha_E)\alpha_{\text{Cont}}$
    | | Fee - - $C_{\text{Fee}} = \alpha_{\text{Fee}}C_{\text{BM}}^\circ$ $=C_p^\circ (1 + \alpha_M)(1 + \alpha_L + \alpha_{\text{FIT}} + \alpha_L \alpha_O + \alpha_E)\alpha_{\text{Fee}}$
    | Auxiliary fee - - - $C_{\text{Aux}}$
  • Bare module cost

    • Lang factor technique - used to estimate cost to build major expansion to existing plant
      • $C = F_{\text{Lang}} \sum C_{p, i}$
    • Module costing technique - used to estimate cost of a new plant
      • $C_{BM} = C_p^\circ F_{BM}$
      • Bare module cost - sum of direct and indirect cost based on base case of equipment built with carbon steel at 1 atm
      • Module costing technique protocol
        • Estimate bare module cost of exchangers, pumps, vessels
          1. Calculate bare module cost (2001) $C_{BM} = C_p^\circ F_{BM}$
            1. Estimate equipment cost at base case $C_p^\circ$
              1. $\log C_P^\circ = K_1 + K_2 \log A + K_3 [\log A]^2$
              2. (Table A.1 gives $K_i$)
              3. Figures A.1 - A.17
            2. Identify relationship of bare module factor $F_{BM}$
              1. $F_{BM} = B_1 + B_2 F_M F_P$
              2. (Table A.4 gives $B_i$)
            3. Estimate pressure factor $F_P$
              1. $\log F_P = C_1 + C_2 \log P + C_3 [\log P]^2 \quad (P [\mathrm{barg}])$
              2. (Table A.2 gives $C_i$)
              3. Vessel
                1. $t = \dfrac{PD}{2SE - 1.2P} + \mathrm{CA} = \dfrac{PD}{2[850 - 0.6P]} + 0.00315 \quad (P [\mathrm{barg}], D[\mathrm{m}])$
                2. $t_{\min} = 0.0063 \ \mathrm{m}$
                3. $F_P =\begin{cases} \dfrac{t}{t_{\min}} & P > -0.5 \ \mathrm{barg} && t > t_{\min} \\ 1 & P > -0.5 \ \mathrm{barg} && t < t_{\min} \\ 1.25 & P < -0.5 \ \mathrm{barg}\end{cases}$
            4. Estimate material factor $F_M$
              1. Table A.3 + Figure A.18 - exchanger, pumps, vessels
          2. Calculate bare module cost with CECPI time correction
            1. $C_2 = C_1 \dfrac{I_2}{I_1}$
        • Estimate bare module factor of other equipment
          1. Table A.5 + Table A.6 + Figure A.19 - compressors, blowers, drives, evaporators, vaporizers, fans, fired heaters, furnaces, power recovery equipment, trays, demister pads, tower packing
          2. Table A.7 - conveyor, crystallizers, dryers, dust collectors, filters, mixers, reactors, screens
          3. Calculate bare module cost with CECPI time correction
            1. $C_2 = C_1 \dfrac{I_2}{I_1}$
    Symbol Conventions
    • Cost
      • $C$ - total cost
      • $C_p$ - Purchased cost of equipment
      • $C_p^\circ$ - Purchased cost of equipment at base condition (built with carbon steel at 1 atm)
      • $C_{BM}$ - Base module cost
    • Factors
      • $F_{\text{Lang}}$ - Lang factor
      • $F_{BM}$ - Base module factor
      • $F_P$ - pressure factor
      • $F_M$ - material factor
    • Others
      • $\alpha$ - Multiplication cost factors
      • $A$ - Equipment capacity
      • $B$ - Correlation fitting parameters
      • $K$ - Correlation fitting parameters
      • $S$ - maximum allowable stress for carbon steel = 944 bar
      • $E$ - weld efficiency = 0.9
      • $D$ - vessel diameter [=] m
      • $P$ - pressure [=] barg
      • $\mathrm{CA}$ - corrosion allowance [=] 0.00315 m
      • $t_{\min}$ - minimum allowable vessel thickness [=] 0.0063 m
  • Grassroots and total module cost

    • Total module cost - cost of making small to moderate expansion or alteration to existing plant
      • Total module cost = bare module cost + contingency + fee
        • Contingency = 15% bare module cost
        • Fee = 3% bare module cost
    • Grassroots (green field) cost - cost of new facility which the construction is started on undeveloped land
      • Grassroot cost = total module cost + auxiliary facility cost
        • Auxiliary facility cost = 50% bare module cost at base condition
    Description Equation
    Total module cost $C_{TM} = \sum C_{TM, i} = 1.18 \sum C_{BM, i}$
    Grassroot cost $C_{GR} = C_{TM} + 0.5 \sum C_{BM, i}^\circ$
  • Plant costs

    Description Equation
    Total module cost of a plant $C_{TM} = C_0 \left(\dfrac{F}{F_0}\right)^n$
    Grassroot cost of a plant $C_{GR} = C_0 \left(\dfrac{F}{F_0}\right)^n$
    Total module cost of parallel plants (trains) $C_{TM, n\text{ trains}} = C_{TM, \text{train}} (n_{\text{trains}})^{0.9}$
    Grassroot cost of parallel plants (trains) $C_{GR, n\text{ trains}} = C_{GR, \text{train}} (n_{\text{trains}})^{0.9}$

Ch 8 Estimation of Manufacturing Costs

  • Factors affecting manufacturing costs

    • Cost of Manufacturing (COM) = DMC + FMC + GE
      • Direct manufacturing costs (DMC) - vary with rate of production
        • Raw materials - costs of chemical feedstock
        • Waste treatment
        • Utility - fuel gas/oil/coal, electric power, steam, cooling water, process water, coiler feed water, instrument air, inert gas, refrigeration
        • Operating labor - costs of operations personnel
        • Direct supervisory and clerical labor - costs of administrative, engineering, and supportive personnel
        • Maintenance and repairs - costs of labor and materials associated with maintenance
        • Operating supplies - cost of misc supplies that support daily operation but not considered to be raw materials
        • Laboratory charges - cost of routine and special lab tests for quality control and troubleshooting
        • Patent and royalties - cost of using patented or licensed technology
      • Fixed manufacturing costs (FMC) - not affected by rate of production
        • Depreciation - costs associated with physical plant (buildings, equipment, etc). Legal operating expense for tax purposes
        • Local taxes and insurance - costs of property taxes and liability insurance
        • Plant overhead costs (factory expenses) - catch-all costs associated with operation of auxiliary facilities, payroll and accounting services, fire protection and safety services, medical services, cafeteria, recreation, payroll overhead, employee benefits, general engineering
      • General expenses (GE) - management-level and admin activities not directly related to manufacturing
        • Admin costs - salary, other admin, building, and activities
        • Distribution and selling costs - costs of sales and marketing
        • Research and development - costs of research activity related to process and product
    Symbol Conventions
    • Cost
      • $\mathrm{COM}$ - total manufacturing cost
      • $\mathrm{COM}_d$ - total manufacturing cost without depreciation
      • $\mathrm{FCI}$ - fixed capital investment
        • $C_{TM}$ - total module cost
        • $C_{GR}$ - grassroot cost
      • $C_{RM}$ - cost of raw materials
      • $C_{WT}$ - cost of waste treatment
      • $C_{UT}$ - cost of utilities
      • $C_{OL}$ - cost of operating labor
    Description Equation
    Total manufacturing cost $\mathrm{COM} = 0.28 \mathrm{FCI} + 2.73 C_{OL} + 1.23(C_{UT} + C_{WT} + C_{RM})$
    Total manufacturing cost without depreciation $\mathrm{COM}_d = 0.18 \mathrm{FCI} + 2.73 C_{OL} + 1.23(C_{UT} + C_{WT} + C_{RM})$
  • Cost of operating labor $C_{OL}$

    • 1 operator = 245 shift/year (49 week/year, 5 shift/week, 8 hour/shift)
    • 1 plant = 1095 shift/year (365 day/year, 3 shift/day, 8 hour/shift)
    • 4.5 operator/$N_{OL}$
    • Wage estimation
      • ✖️ Do not use CEPCI
      • ✔️ Use The Oil and Gas Journal and Engineering News Record
        • 66910 $/year (2080 hour/year) (May 2016, Texas)
        • 32.16 $/hour
    Description Equation
    Number of operators per shift
    ★ $P \le 2$
    $N_{OL} = (6.29 + 31.7 P^2 + 0.23 N_{np})^{0.5}$
    Number of particular solid process $P$
    Number of nonparticular processes that are
    [Compressor, tower, reactor, heater, exchanger]
    $N_{np}$
  • Utility cost $C_{UT}$

    • Battery limit - boundary of responsibility; PFD only include core unit operations, but not units that generate utilities.
    • Types of fuels
      • Coal - negative environmental impact, used near mines
      • No. 6 fue oil - heavy oil with high sulfur content
      • Natural gas - high regional variation of price
      • No. 2 fuel oil - used near coast, large price fluctuation
      • Electricity - generated by all sources
        • Only electricity can be predicted by CEPCI
    • Utility supply methods
      • Purchasing from public or private utility
      • Supplied by company
      • Self-generated and used by a single process unit
    • Types of utilities
      • Air supply - pressurized and dried air
      • Steam from boilers - process steam providing latent heat
      • Steam generated from process - process steam providing heat
      • Cooling tower water - process cooling water
      • Other water
      • Electrical substation
      • Fuels
      • Refrigeration
      • Thermal system
      • Waste disposal
      • Wastewater treatment
    • Estimate utility cost
      • Capital investment to build a facility to supply utility - use grassroot cost for FCI
      • Table 8.3
  • Raw material cost $C_{RM}$

    • Table 8.4
    • Stream factor (SF) - fraction of time that the plant is operating in a year
      • $\mathrm{SF} \in [0.90, 0.96]$
  • Waste treatment cost $C_{WT}$

    • Table 8.3

Ch 9 Engineering Economic Analysis

  • Investments and the time value of money

    • Goal of manufacturing company: make money
    • Companies produce high value chemicals from low value raw materials
    • Personal income
      • Basic standard of living
      • Discretionary money
        • Consume money for now
        • Retain money for future
          • Simple savings
          • Investments
    • Money makes money when invested.
    • Investment - agreement between investor and producer with the expectation that the producer will return money to the investor at some specified future dates
      • Investor - party providing money $P$ (principal/present value)
      • Producer - party expected to return money $F$ (future value)
      • EQNS
    • Savings - people invest in bank
    • Loan - bank invest in people
    • Money - measure of the value of products and services
    • Value - other units to measure value of products and services
    • Usually, company is investor in project
    • Time value of money - Money today is worth more than money in the future
  • Different types of interest

    • Simple interest - amount of interest paid is based only on initial investment
    • Compound interest - interest earned is reinvested
    Description Equation
    Simple interest $F_n = P(1 + i_s n)$
    Compound interest $F_n = P(1 + i)^n$
    Compound interest with changing interest rates $\begin{aligned}F_n &= P \prod_{j = 1}^n (1 + i_j) \\ &= P(1+i_1)(1+i_2)\cdots(1+i_n)\end{aligned}$
  • Time basis for compound interest

    • Nominal annual interest rate $i_{\text{nom}}$ - annual interest rate if compounded per year
    • Actual rate $r$ - interest rate per compounding period
    • Effective annual interest rate $i_{\text{eff}}$ - annual interest rate if not compounded per year
    Description Equation
    Actual rate
    ★ $m$ - number of compounding period per year
    $r = \dfrac{i_{\text{nom}}}{m}$
    Effective annual interest rate $i_{\text{eff}} = \left(1 + \dfrac{i_{\text{nom}}}{m}\right)^m - 1$
    Continuous compounding $i_{\text{eff}} = \exp(i_{\text{nom}}) - 1$
  • Annuity and discount factors

    • When cash flows occur at different times, each cash flow must be brought to the same point in time for comparison
    • Annuity - a series of uniform cash transactions taken place at the end of each year for some consecutive years
    • Discount factor - conversion factor converting present, future, and annuity values as a function of $i$ and $n$
    Conversion Symbol Common Name Formula
    $P$ to $F$ $F/P$ Single payment compound amount factor $(1+i)^n$
    $F$ to $P$ $P/F$ Single payment present worth factor $\dfrac{1}{(1+i)^n}$
    $A$ to $F$ $F/A$ Uniform series compound amount factor;
    Future worth of annuity
    $\dfrac{(1+i)^n - 1}{i}$
    $F$ to $A$ $A/F$ Sinking fund factor $\dfrac{1}{(1+i)^n - 1}$
    $P$ to $A$ $A/P$ Capital recovery factor $\dfrac{i(1+i)^n}{(1+i)^n - 1}$
    $A$ to $P$ $P/A$ Uniform series present worth factor;
    Present worth of annuity
    $\dfrac{(1+i)^n - 1}{i(1+i)^n}$
  • Inflation

    Description Equation
    Purchasing power of future cash $F' = \dfrac{F}{(1+f)^n} = P(1 + i')^n$
    Effective interest rate $i' = \dfrac{1+i}{1+f} - 1 = \dfrac{i-f}{1+f}$
    Effective interest rate approximation
    ★ $f < 0.05$
    $i' \approx i - f$
  • Depreciation of capital investment

    • Capital depreciation - difference between purchase and installation expense and salvage value

    • Total Capital investment = Fixed capital + Working capital

      • Fixed capital - cost for building the plant
        • Land cannot be depreciated
      • Working capital - capital required to start up the plant and finance the first few months of operation
        • Working capital cannot be depreciated
    • Depreciation metrics

      • Fixed capital investment $\mathrm{FCI_L}$ - depreciable capital investment
        • $\mathrm{FCI_L} =$ (cost to build the plant) - (cost of land)
      • Salvage value $S$ - fixed capital investment minus land evaluated at the end of plant life
      • Life of the equipment $n$ - IRS equipment depreciation time (currently 9.5 years)
      • Total capital for depreciation $D$
        • $D = \mathrm{FCI_L} - S$
      • Yearly depreciation $d_k$ - amount of depreciation in the $k$th year
      • Book value $\mathrm{BV_k}$ - amount of depreciable capital that has not yet been depreciated
        • $\mathrm{BC_k = FCI_L} - \sum d_j$
    • Depreciation methods

      • Straight-line depreciation method (SL) - equal amount of depreciation is charged each year over the depreciation period allowed
        • $d_k^{SL} = \dfrac{\mathrm{FCI_L - S}}{n}$
      • Sum of the years digits depreciation method (SOYD)
        • $d_k^{SOYD} = \dfrac{(n + 1 - k)(\mathrm{FCI_L} - S)}{\dfrac{n}{2}(n+1)}$
      • Double declining balance depreciation method (DDB)
        • $d_k^{DDB} = \dfrac{2}{n} \left[\mathrm{FCI_L} - \displaystyle\sum_{j = 0}^{k-1} d_j\right]$
      • Modified accelerated cost recovery system (MACRS)
        • Use half year convention - equipment is bought midway through first year that depreciation is allowed
        • Most equipment has 9.5 year class life, 5 year recovery period, and no salvage value
        • Use DDB method then SL method when SL yields greater depreciation allowance
    • Taxation, cash flow, profit

      • Federal, state, city, local taxes are high for large corporations
      • Revenue $R$
      • Cost of manufacturing $\mathrm{COM}_d$ - excludes depreciation
      • Depreciation $d$
      • Tax rate $t$
      • Expense = Manufacturing costs + Depreciation
        • $E = \mathrm{COM}_d + d$
      • Income tax = (Revenue - Expenses)(Tax rate)
        • $(R - \mathrm{COM}_d - d)(t)$
      • After-tax = Revenue - Expense - Income tax
        • $(R - \mathrm{COM}_d - d)(1-t)$

Ch 10 Profitability Analysis

  • Project cash flow diagram

    • Uses cumulative cash flow diagram
      • Assume land purchase is done at $t = 0$
      • Fixed capital investment ($\mathrm{FCI_L}$) at project construction years
      • Working capital (WC) at plant start-up
      • Teething problem - revenue for first year after start-up is less than subsequent years
      • Assume a working life for profitability analysis
      • Land, working capital, and salvage recovered at ebd of life
  • Profitability criteria

    • Time, cash, interest rate

    • Nondiscounted profitability criteria

      • Payback period (PBP) - time required after start-up to recover the fixed capital investment ($\mathrm{FCI_L}$) for the project
      • Cumulative cash position (CCP) - Worth of the project at the end of life
      • Cumulative cash ratio (CCR)
        • $\mathrm{CCR} = \dfrac{\sum \text{Positive cash flow}}{\sum \text{Negative cash flow}} = 1 + \dfrac{\mathrm{CCP}}{\text{Land + WC +}\mathrm{FCI_L}}$
      • Rate of return on investment (ROROI)
        • $\mathrm{ROROI} = \dfrac{\text{Average annual net profit}}{\mathrm{FCI_L}} = \dfrac{\text{Slope startup-to-post-salvage curve}}{\mathrm{FCI_L}} - \dfrac{1}{n}$
    • Discounted profitability criteria

      • Discounted payback period (DPBP) - time required after start-up to recover fixed capital investment $\mathrm{FCI_L}$ for the project with all cash flows discounted back to $t = 0$
      • Net present value (NPV) - discounted cumulative cash position at the end of the project
      • Present value ratio (PVR)
        • $\mathrm{PVR} = \dfrac{\sum \text{Present value of positive cash flow}}{\sum \text{Present value of negative cash flow}}$
      • Discounted cash flow rate of return (DCFROR) - interest or discount rate for which net present value of the project equals to zero (break even)
    • Evaluation of equipment alternatives

      • Equipment with same expected operating lives and operating costs
        • Choose less expensive one
      • Equipment with same expecting operating lives
        • Choose less negative NPV
      • Equipment with different operating lives
        • Capitalized cost method
          • Fund needed to purchase equipment, replace at the end of life, and continue replacing it
          • Do not include operating cost
          • Equipment cost $P$
          • Residual $R$
          • Equipment life $n_{eq}$
          • Capitalized cost = $P+R = P \left[\dfrac{(1+i)^{n_{eq}}}{(1+i)^{n_{eq}} - 1}\right]$
        • Equivalent capitalized cost (ECC) method
          • Yearly operating cost (YOC)
          • Capitalized operating cost = $\dfrac{\mathrm{YOC}(\frac{F}{A})}{(1+i)^{n_{eq}}-1}$
          • Equivalent capitalized cost (ECC) = Capitalized cost + Capitalized operating cost = $\dfrac{P(1+i)^{n_{eq}} + \mathrm{YOC}(\frac{F}{A})}{(1+i)^{n_{eq}}-1}$
          • Residual R = ECC - P - YOC
        • Equivalent annual operating cost (EAOC) method
          • $\mathrm{EAOC} = (\text{Capital investment})(\frac{A}{P}) + \mathrm{YOC}$

-★- Synthesis and Optimization of Chemical Processes

Ch 11 Design Heuristics

  • Heuristic - statement concerning equipment sizes, operating conditions, and equipment performance that reduces need for calculations

  • Shortcut method - faster method that replaces extensive calculation to evaluate equipment sizes, operating conditions, and equipment performance

  • Compressors

    • If $P_{out}/P_{in} > 3$, use multiple stages of compressors (which will raise $T$) and intercooling between compressors
    • If hot inlet gas, cool it before compression
  • Heat exchangers

    • Heat integration - use heat generated in one part of the process to heat up other parts
    • If $\Delta T_{lm} > 100 \deg C$, need better heat integration
    • If stream have diff $T$ for mixing, need better heat integration

Ch 12 Reactor and Separation Design Heuristics

  • Table 12.1 - choice of separation units
    • Example: separate A, B, C needs $\ge 2$ sep units. need design decisions to optimize cost-effectiveness
      • Sep A, then Sep B and C
      • Sep B, then Sep A and C
      • Sep C, then Sep A and B
    • Almost always need $(n-1)$ separation units for $n$ species
    • Number of ways to configure separation units: $S = \dfrac{[2(N-1)]!}{N! (N-1)!}$
      • Example: separate 4 components, need 3 columns, $S=5$ configurations
  • Table 12.2 - choice of sequencing separation units
    • Remove the largest product stream first if possible