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[[File:Crude oil-fired power plant.jpg|thumb|right|225px|Industrial air pollution source]]
Atmospheric dispersion modeling is the mathematical simulation of how air pollutants disperse in the ambient atmosphere. It is performed with computer programs that solve the mathematical equations and algorithms which simulate the pollutant dispersion. The dispersion models are used to estimate or to predict the downwind concentration of air pollutants emitted from sources such as industrial plants, vehicular traffic or accidental chemical releases.


'''Gasoline''' or '''petrol''' is derived from [[petroleum crude oil]]. Conventional gasoline is mostly a blended mixture of more than 200 different [[hydrocarbon]] [[liquid]]s ranging from those containing 4 [[carbon]] [[atom]]s to those containing 11 or 12  carbon atoms. It has an initial [[boiling point]] at [[atmospheric pressure]] of about 35 °[[Celsius|C]] (95 °[[Fahrenheit|F]]) and a final boiling point of about 200 °C (395 °F).<ref name=FAQ>[http://www.faqs.org/faqs/autos/gasoline-faq/part4/ Gasoline FAQ - Part2 of 4], Bruce Hamilton, Industrial Research Ltd. (IRL), a [[Crown Research Institute]] of [[New Zealand]].</ref><ref>{{cite book|author=Gary, J.H. and Handwerk, G.E.|title=Petroleum Refining Technology and Economics|edition=2nd Edition|publisher=Marcel Dekker, Inc.|pages=page 8|year=1984|id=ISBN 0-8247-7150-8}}</ref><ref name=Assi>[http://hqweb.unep.org/pcfv/PDF/JordanWrkshp-Unleaded-Rafat.pdf The Relation Between Gasoline Quality, Octane Number and the Environment], Rafat Assi, National Project Manager of Jordan’s Second National Communications on Climate Change, Presented at Jordan National Workshop on Lead Phase-out, [[United Nations]] Environment Programme, July 2008, [[Amman]], [[Jordan]].</ref><ref>{{cite book|author=James Speight|title=Synthetic Fuels Handbook|edition=1st Edition|publisher=McGraw-Hill|pages=pages 92-93|year=2008|id=ISBN 0-07-149023-X}}</ref> Gasoline is used primarily as fuel for the [[internal combustion engine]]s in automotive vehicles as well in some small airplanes.
Such models are important to governmental agencies tasked with protecting and managing the ambient air quality. The models are typically employed to determine whether existing or proposed new industrial facilities are or will be in compliance with the National Ambient Air Quality Standards (NAAQS) in the United States or similar regulations in other nations. The models also serve to assist in the design of effective control strategies to reduce emissions of harmful air pollutants. During the late 1960's, the Air Pollution Control Office of the U.S. Environmental Protection Agency (U.S. EPA) initiated research projects to develop models for use by urban and transportation planners.<ref>J.C. Fensterstock et al, "Reduction of air pollution potential through environmental planning", ''JAPCA'', Vol. 21, No. 7, 1971.</ref>   
   
In [[Canada]] and the [[United States]], the word "gasoline" is commonly used and it is often shortened to simply "gas" although it is a liquid rather than a [[gas]]. In fact, gasoline-dispensing facilities are referred to as "gas stations".


Most current or former [[Commonwealth of Nations|Commonwealth countries]] use the term "petrol" and dispensing facilities are referred to as "petrol stations". The term "petrogasoline" is also used sometimes. In some European countries and elsewhere, the term "benzin" (or a variant of that word) is used to denote gasoline.  
Air dispersion models are also used by emergency management personnel to develop emergency plans for accidental chemical releases. The results of dispersion modeling, using worst case accidental releases and meteorological conditions, can provide estimated locations of impacted areas and be used to determine appropriate protective actions. At industrial facilities in the United States, this type of consequence assessment or emergency planning is required under the Clean Air Act (CAA) codified in Part 68 of Title 40 of the Code of Federal Regulations.


In aviation, "mogas" (short for "motor gasoline") is used to distinguish automotive vehicle fuel from aviation fuel known as "avgas". 
The dispersion models vary depending on the mathematics used to develop the model, but all require the input of data that may include:


== Gasoline production from crude oil ==
* Meteorological conditions such as wind speed and direction, the amount of atmospheric turbulence (as characterized by what is called the "stability class"), the ambient air temperature, the height to the bottom of any inversion aloft that may be present, cloud cover and solar radiation.
* The emission parameters such the type of source (i.e., point, line or area), the mass flow rate, the source location and height, the source exit velocity, and the source exit temperature.
* Terrain elevations at the source location and at receptor locations, such as nearby homes, schools, businesses and hospitals.
* The location, height and width of any obstructions (such as buildings or other structures) in the path of the emitted gaseous plume as well as the terrain surface roughness (which may be characterized by the more generic parameters "rural" or "city" terrain).


{{Image|Refinery Products Barrel.png|right|250px|Average U.S. refinery product yields.}}
Many of the modern, advanced dispersion modeling programs include a pre-processor module for the input of meteorological and other data, and many also include a post-processor module for graphing the output data and/or plotting the area impacted by the air pollutants on maps. The plots of areas impacted usually include isopleths showing areas of pollutant concentrations that define areas of the highest health risk. The isopleths plots are useful in determining protective actions for the public and first responders.


Gasoline and other end-products are produced from petroleum crude oil in [[Petroleum refining processes|petroleum refineries]]. It is very difficult to quantify the amount of gasoline produced by refining a given amount of crude oil for  a number of reasons:
The atmospheric dispersion models are also known as atmospheric diffusion models, air dispersion models, air quality models, and air pollution dispersion models.


* There are quite literally hundreds of different crude oil sources worldwide and each crude oil has its own unique mixture of thousands of hydrocarbons and other materials.
==Atmospheric layers==


* There are also hundreds of crude oil refineries worldwide and each of them is designed to process a specific crude oil or a specific set of crude oils. Furthermore, each refinery has its own unique configuration of [[petroleum refining processes]] that produces its own unique set of gasoline blend components.
Discussion of the layers in the Earth's atmosphere is needed to understand where airborne pollutants disperse in the atmosphere. The layer closest to the Earth's surface is known as the ''troposphere''. It extends from sea-level up to a height of about 18 km and contains about 80 percent of the mass of the overall atmosphere. The ''stratosphere'' is the next layer and extends from 18 km up to about 50 km. The third layer is the ''mesosphere'' which extends from 50 km up to about 80 km. There are other layers above 80 km, but they are insignificant with respect to atmospheric dispersion modeling.


* There are a great many different gasoline specifications that have been mandated by various local, state or national governmental agencies.  
The lowest part of the troposphere is called the ''atmospheric boundary layer (ABL)'' or the ''planetary boundary layer (PBL)'' and extends from the Earth's surface up to about 1.5 to 2.0 km in height. The air temperature of the atmospheric boundary layer decreases with increasing altitude until it reaches what is called the ''inversion layer'' (where the temperature increases with increasing altitude) that caps the atmospheric boundary layer. The upper part of the troposphere (i.e., above the inversion layer) is called the ''free troposphere'' and it extends up to the 18 km height of the troposphere.


* In many geographical areas, the amount of gasoline produced during the summer season (i.e., the season of the greatest demand for automotive gasoline) varies significantly from the amount produced during the winter season.
The ABL is the most important layer with respect to the emission, transport and dispersion of airborne pollutants. The part of the ABL between the Earth's surface and the bottom of the inversion layer is known as the ''mixing layer''. Almost all of the airborne pollutants emitted into the ambient atmosphere are transported and dispersed within the mixing layer. Some of the emissions penetrate the inversion layer and enter the free troposphere above the ABL.


However, from the data presented in the adjacent image as an average of all the refineries operating in the United States in 2007,<ref>[http://www.eia.doe.gov/bookshelf/brochures/gasoline/index.html Where Does My Gasoline Come from?], [[U.S. Department of Energy]], [[Energy Information Administration]], April 2008.</ref> refining a barrel of crude oil (i.e., 42 [[U.S. customary units|gallons]] or 159 [[litre]]s) yielded 19.2 gallons (72.7 litres) of end-product gasoline. That is a volumetric yield of 45.7 percent. The average refinery yield of gasoline in other countries may be different.
In summary, the layers of the Earth's atmosphere from the surface of the ground upwards are: the ABL made up of the mixing layer capped by the inversion layer; the free troposphere; the stratosphere; the mesosphere and others. Many atmospheric dispersion models are referred to as ''boundary layer models'' because they mainly model air pollutant dispersion within the ABL. To avoid confusion, models referred to as ''mesoscale models'' have dispersion modeling capabilities that can extend horizontally as much as  a few hundred kilometres. It does not mean that they model dispersion in the mesosphere.


From a marketing viewpoint, the most important characteristic of a gasoline is its [[octane rating]]  (discussed  later in this article). [[Paraffin|Paraffinic hydrocarbons]] ([[alkane]]s) wherein all of the carbon atoms are in a straight chain have the poorest octane ratings. Hydrocarbons with more complicated configurations such as [[aromatic]]s, [[olefin]]s and highly branched [[paraffin]]s have much higher octane ratings. To that end, many of the refining processes used in petroleum refineries are designed to produce hydrocarbons with those more complicated configurations.
==Gaussian air pollutant dispersion equation==


Some of the most important refinery process streams that are blended together to obtain the end-product gasolines<ref>See the schematic flow diagram in the [[Petroleum refining processes]] article.</ref> are:
The technical literature on air pollution dispersion is quite extensive and dates back to the 1930s and earlier. One of the early air pollutant plume dispersion equations was derived by Bosanquet and Pearson.<ref>C.H. Bosanquet and J.L. Pearson, "The spread of smoke and gases from chimneys", ''Trans. Faraday Soc.'', 32:1249, 1936.</ref> Their equation did not assume Gaussian distribution nor did it include the effect of ground reflection of the pollutant plume.


*''Reformate'' (produced in a [[Catalytic reforming|catalytic reformer]]): has a high content of aromatic hydrocarbons and a very low content of olefinic hydrocarbons ([[alkene]]s).
Sir Graham Sutton derived an air pollutant plume dispersion equation in 1947<ref>O.G. Sutton, "The problem of diffusion in the lower atmosphere", ''QJRMS'', 73:257, 1947.</ref><ref>O.G. Sutton, "The theoretical distribution of airborne pollution from factory chimneys", ''QJRMS'', 73:426, 1947.</ref> which did include the assumption of Gaussian distribution for the vertical and crosswind dispersion of the plume and also included the effect of ground reflection of the plume.
*''Catalytically cracked gasoline'' (produced in a [[Fluid catalytic cracking|fluid catalytic cracker]]): has a high content of olefinic hydrocarbons and a moderate amount of aromatic hydrocarbons.  
*''Hydrocrackate'' (produced in a [[Hydrocracking|hydrocracker]]): has a moderate content of aromatic hydrocarbons.
*''Alkylate'' (produced in an [[Alkylation process|alkylation unit]]): has a high content of highly branched paraffinic hydrocarbons such as [[isooctane]].  
*''Isomerate'' (produced in a [[Catalytic isomerization|catalytic isomerization unit]]): has a high content of the branched [[isomers]] of [[pentane]] and [[hexane]].


== Gasoline formulations and air quality regulations ==
Under the stimulus provided by the advent of stringent environmental control regulations, there was an immense growth in the use of air pollutant plume dispersion calculations between the late 1960s and today. A great many computer programs for calculating the dispersion of air pollutant emissions were developed during that period of time and they were commonly called "air dispersion models". The basis for most of those models was the '''Complete Equation For Gaussian Dispersion Modeling Of Continuous, Buoyant Air Pollution Plumes''' shown below:<ref name=Beychok>{{cite book|author=M.R. Beychok|title=Fundamentals Of Stack Gas Dispersion|edition=4th Edition| publisher=author-published|year=2005|isbn=0-9644588-0-2}}.</ref><ref>{{cite book|author=D. B. Turner| title=Workbook of atmospheric dispersion estimates: an introduction to dispersion modeling| edition=2nd Edition |publisher=CRC Press|year=1994|isbn=1-56670-023-X}}.</ref>


=== In the United States ===


There is no "standard" composition or set of specifications for gasoline. In the United States, because of the complex national and individual state and local programs to improve air quality, as well as local refining and marketing decisions, petroleum refiners must supply fuels that meet many different standards. State and local air quality regulations involving gasoline overlap with national regulations and that leads to adjacent or nearby areas having significantly different gasoline specifications. According to a detailed study in 2006, <ref name=CRS>[http://www.scribd.com/doc/1537932/US-Air-Force-rl31361 CRS Report For Congress] ''"Boutique Fuels" and Reformulated Gasoline: Harmonization of Fuel Standards'' (May 10, 2006) , Brent D. Yacobucci, Congressional Research Service, [[Library of Congress]]</ref> there were at least 18 different gasoline formulations required across the United States in 2002. Since many petroleum refiners in the United States produce three grades of fuel and the specifications for fuel marketed in the summer season vary significantly from the specifications in the winter season, that number may have been greatly understated. In any event, the number of fuel formulations has probably increased quite a bit since 2002. In the United States, the various fuel formulations are often referred to as "boutique fuels".<ref name=CRS/><ref>[http://www.epa.gov/oms/boutique.htm Boutique Fuels: State and Local Clean Fuels Programs] From the website of the [[U.S. Environmental Protection Agency]]</ref><ref>[http://www.epa.gov/oms/boutique/420r06901.pdf EPAct Section 1541 Boutique Fuels Report to Congress] Report No. EPA420-R-06-901, December 2006, co-authored by the U.S. Environmental Protection Agency and the [[U.S. Department of Energy]].</ref>
<math>C = \frac{\;Q}{u}\cdot\frac{\;f}{\sigma_y\sqrt{2\pi}}\;\cdot\frac{\;g_1 + g_2 + g_3}{\sigma_z\sqrt{2\pi}}</math>


Some of the major properties and gasoline components that are the focus of regulation by the various national and state or local programs are:
{| border="0" cellpadding="2"
 
|-
*[[Vapor pressure]]: The vapor pressure of a gasoline is a measure of its propensity to evaporate. Evaporative [[emission]]s of the hydrocarbons in the gasoline lead to the formation of [[ozone]] in the atmosphere which reacts with vehicular and industrial emissions of [nitrogen oxides]] (NOx) to form what is called ''[[photochemical smog]]''. ''Smog'' is a combination of the words ''smoke '' and ''fog'' and  traditionally referred to the mixture of smoke and [[sulfur dioxide]] that resulted from the burning of coal for heating buildings in places such as [[London]], [[England]]. Modern photochemical smog does not come from coal burning but from vehicular and industrial emissions of hydrocarbons and nitrogen oxides. It appears as a brownish haze over large urban areas and is irritating to the eyes and lungs.
|align=right|where:
 
|&nbsp;
*Nitrogen oxides: (catalytic converters?)
|-
 
!align=right|<math>f</math> 
*Heavy metals: (lead)
|align=left|= crosswind dispersion parameter
 
|-
*Toxic compounds: (Benzene, aromatics?)
!align=right|&nbsp;
 
|align=left|= <math>\exp\;[-\,y^2/\,(2\;\sigma_y^2\;)\;]</math>
*[[Sulfur]]:
|-
 
!align=right|<math>g</math>  
*[[Oxygen]]:
|align=left|= vertical dispersion parameter = <math>\,g_1 + g_2 + g_3</math>
 
|-
{| class = "wikitable" align="center"
!align=right|<math>g_1</math>
|+ California Reformulated Gasoline (CaRFG) Phase 3 Standards<ref>http://www.arb.ca.gov/fuels/gasoline/carfg/082908.pdf Final Regulation Order] 2007 Amendments to California Phase 3 Reformulated Gasoline Regulation, California Code of Regulations, Title 13, Section 2260</ref><br>Effective as of August 29, 2008<ref>[http://www.arb.ca.gov/fuels/gasoline/carfg3/carfg3.htm California Phase 3 Reformulated Gasoline (CaRFG)]</ref>
|align=left|= vertical dispersion with no reflections
! Property!!Measurement<br>unit!!Flat Limit!!Average Limit
|-
|-  
!align=right|&nbsp;
|align="center"|[[Reid vapor pressure]]<sup> (a)</sup>||align="center"|[[U.S. customary units|psi]]<sup> (b)</sup>||align="center"|7.00 or 6.90<sup> (c)</sup>||align="center"|not applicable
|align=left|= <math>\; \exp\;[-\,(z - H)^2/\,(2\;\sigma_z^2\;)\;]</math>
|-  
|-
|align="center"|Sulfur [[concentration]]||align="center"|[[Parts per notation|ppmw]]||align="center"|20||align="center"|15
!align=right|<math>g_2</math>
|-  
|align=left|= vertical dispersion for reflection from the ground
|align="center"|[[Benzene]] concentration||align="center"|[[Parts per notation|ppmv]]||align="center"|0.8||align="center"|0.7
|-
|-  
!align=right|&nbsp;
|align="center"|[[Hydrocarbons|Aromatics]] concentration||align="center"|ppmv||align="center"|25.0 ||align="center"|22.0
|align=left|= <math>\;\exp\;[-\,(z + H)^2/\,(2\;\sigma_z^2\;)\;]</math>
|-  
|-
|align="center"|[[Hydrocarbons|Olefins]] concentration||align="center"|ppmv||align="center"|6.0 ||align="center"|4.0
!align=right|<math>g_3</math>
|align=left|= vertical dispersion for reflection from an inversion aloft
|-
!align=right|&nbsp;
|align=left|= <math>\sum_{m=1}^\infty\;\big\{\exp\;[-\,(z - H - 2mL)^2/\,(2\;\sigma_z^2\;)\;]</math>
|-
!align=right|&nbsp;
|align=left|&nbsp; &nbsp; &nbsp; &nbsp; &nbsp; <math>+\, \exp\;[-\,(z + H + 2mL)^2/\,(2\;\sigma_z^2\;)\;]</math>
|-
!align=right|&nbsp;
|align=left|&nbsp; &nbsp; &nbsp; &nbsp; &nbsp; <math>+\, \exp\;[-\,(z + H - 2mL)^2/\,(2\;\sigma_z^2\;)\;]</math>
|-
!align=right|&nbsp;
|align=left|&nbsp; &nbsp; &nbsp; &nbsp; &nbsp; <math>+\, \exp\;[-\,(z - H + 2mL)^2/\,(2\;\sigma_z^2\;)\;]\big\}</math>
|-
|-
|align="center"|[[Temperature]] at 50 volume % distilled (T50)||align="center"|°[[Fahrenheit|F]]<sup> d</sup>||align="center"|213||align="center"|203
!align=right|<math>C</math>
|align=left|= concentration of emissions, in g/m³, at any receptor located:
|-
|-
|align="center"|Temperature at 90 volume % distilled (T90)||align="center"|°F||align="center"|305 ||align="center"|295
!align=right|&nbsp;
|align=left|&nbsp; &nbsp; &nbsp; &nbsp; &nbsp; x meters downwind from the emission source point
|-
|-
|align="center"|Oxygen concentration||align="center"|weight %<sup> (e)</sup>||align="center"|1.8 – 2.2 ||align="center"|not applicable
!align=right|&nbsp;
|align=left|&nbsp; &nbsp; &nbsp; &nbsp; &nbsp; y meters crosswind from the emission plume centerline
|-
|-
|align="center"|Oxygenates other than ethanol||align="center"|--||align="center"|prohibited ||align="center"|not applicable
!align=right|&nbsp;
|align=left|&nbsp; &nbsp; &nbsp; &nbsp; &nbsp; z meters above ground level
|-
|-
|colspan=4|(a) Reid vapor pressure (RVP) is measured as per [[ASTM]] method D-323 and differs slightly from the true<br>absolute [[vapor pressure]].<br>
!align=right|<math>Q</math>
(b) 1 psi = 6.89 k[[Pascal (unit)|Pa]]<br>
|align=left|= source pollutant emission rate, in g/s
(c) The Reid vapor pressure flat limit of 6.90 psi applies when a California gasoline producer or importer<br> uses the CaRFG Phase 3 Predictive Model to certify a gasoline blend not containing ethanol. Otherwise,<br> the 7.0 psi limit applies.<br>
(d) °C = (°F − 32)(5/9) <br>
(e) Volume % ethanol in gasoline = [(0.3529/weight % oxygen) − 0.0006]<sup> −1</sup> and thus 1.8 – 2.2 weight  %<br>oxygen in a gasoline equals 5.1 – 6.3 volume % ethanol in the gasoline.<ref>[http://www.arb.ca.gov/regact/mtbepost/appe.PDF Miscellaneous Cleanup Amendments to the California Reformulated Gasoline Regulations]</ref>
|}
 
=== In Europe ===
{| class = "wikitable" align="center"
|+ Unleaded Gasoline Category 2 and Category 3 Standards<ref>[http://www.acea.be/images/uploads/pub/Final%20WWFC%204%20Sep%202006.pdf Worldwide Fuel Charter, Fourth Edition, September 2006] published by the European Automobile Manufacturers Association (ACEA)</ref><br>of the European Automobile Manufacturers Association (ACEA)
! Property!!Measurement<br>unit!!Category 2!!Category 3
|-
|align="center"|[[Octane Rating]]<sup> (a)</sup> range||align="center"|--||align="center"|87 – 93||align="center"|87 – 93
|-
|-
|align="center"|[[Reid vapor pressure]]<sup> (a)</sup>||align="center"|[[U.S. customary units|psi]]<sup> (b)</sup>||align="center"|7.00 or 6.90<sup> (c)</sup>||align="center"|not applicable
!align=right|<math>u</math>
|-
|align=left|= horizontal wind velocity along the plume centerline, m/s
|align="center"|Sulfur [[concentration]]||align="center"|[[Parts per notation|ppmw]]||align="center"|20||align="center"|15
|-
|align="center"|[[Benzene]] concentration||align="center"|[[Parts per notation|ppmv]]||align="center"|0.8||align="center"|0.7
|-
|align="center"|[[Hydrocarbons|Aromatics]] concentration||align="center"|ppmv||align="center"|25.0 ||align="center"|22.0
|-
|align="center"|[[Hydrocarbons|Olefins]] concentration||align="center"|ppmv||align="center"|6.0 ||align="center"|4.0
|-
|-
|align="center"|[[Temperature]] at 50 volume % distilled (T50)||align="center"|°[[Fahrenheit|F]]<sup> d</sup>||align="center"|213||align="center"|203
!align=right|<math>H</math>
|align=left|= height of emission plume centerline above ground level, in m
|-
|-
|align="center"|Temperature at 90 volume % distilled (T90)||align="center"|°F||align="center"|305 ||align="center"|295
!align=right|<math>\sigma_z</math>
|align=left|= vertical standard deviation of the emission distribution, in m
|-
|-
|align="center"|Oxygen concentration||align="center"|weight %<sup> (e)</sup>||align="center"|1.8 – 2.2 ||align="center"|not applicable
!align=right|<math>\sigma_y</math>
|align=left|= horizontal standard deviation of the emission distribution, in m
|-
|-
|align="center"|Oxygenates other than ethanol||align="center"|--||align="center"|prohibited ||align="center"|not applicable
!align=right|<math>L</math>
|align=left|= height from ground level to bottom of the inversion aloft, in m
|-
|-
|colspan=4|(a) Reid vapor pressure (RVP) is measured as per [[ASTM]] method D-323 and differs slightly from the true<br>absolute [[vapor pressure]].<br>
!align=right|<math>\exp</math>
(b) 1 psi = 6.89 k[[Pascal (unit)|Pa]]<br>
|align=left|= the exponential function
(c) The Reid vapor pressure flat limit of 6.90 psi applies when a California gasoline producer or importer<br> uses the CaRFG Phase 3 Predictive Model to certify a gasoline blend not containing ethanol. Otherwise,<br> the 7.0 psi limit applies.<br>
(d) °C = (°F − 32)(5/9) <br>
(e) Volume % ethanol in gasoline = [(0.3529/weight % oxygen) − 0.0006]<sup> −1</sup> and thus 1.8 – 2.2 weight  %<br>oxygen in a gasoline equals 5.1 – 6.3 volume % ethanol in the gasoline.<ref>[http://www.arb.ca.gov/regact/mtbepost/appe.PDF Miscellaneous Cleanup Amendments to the California Reformulated Gasoline Regulations]</ref>
|}
|}


=== In India ===
The above equation not only includes upward reflection from the ground, it also includes downward reflection from the bottom of any inversion lid present in the atmosphere.


== Properties that determine the performance of gasoline ==
The sum of the four exponential terms in <math>g_3</math> converges to a final value quite rapidly. For most cases, the summation of the series with '''''m''''' = 1, '''''m''''' = 2 and '''''m''''' = 3 will provide an adequate solution.
{{Image|Iso-octane and n-Heptane.png|right|250px|Simplified structure of 2,2,4-trimethylpentane and n-heptane.}}


=== Octane rating ===
<math>\sigma_z</math> and <math>\sigma_y</math> are functions of the atmospheric stability class (i.e., a measure of the turbulence in the ambient atmosphere) and of the downwind distance to the receptor. The two most important variables affecting the degree of pollutant emission dispersion obtained are the height of the emission source point and the degree of atmospheric turbulence. The more turbulence, the better the degree of dispersion.


{{main|Octane rating}}
Whereas older models rely on stability classes for the determination of <math>\sigma_y</math> and <math>\sigma_z</math>, more recent models increasingly rely on Monin-Obukhov similarity theory to derive these parameters.
An important characteristic of gasoline is its octane rating, which is a measure of how resistant gasoline is to the abnormal combustion phenomenon known as [[engine knocking|pre-detonation]] (also known as knocking, pinging, spark knock, and other names). [[Deflagration]] is the normal type of combustion.  Octane rating is measured relative to a mixture of [[2,2,4-Trimethylpentane|2,2,4-trimethylpentane]] (an [[isomer]] of [[octane]]) and n-[[heptane]].  There are a number of different conventions for expressing the octane rating; therefore, the same fuel may be labeled with a different number, depending upon the system used.
<BR><BR><BR><BR><BR><BR><BR><BR><BR><BR>


=== Vapor pressure ===
==Briggs plume rise equations==


=== Sulfur content ===
The Gaussian air pollutant dispersion equation (discussed above) requires the input of ''H'' which is the pollutant plume's centerline height above ground level. ''H'' is the sum of ''H''<sub>s</sub> (the actual physical height of the pollutant plume's emission source point) plus Δ''H'' (the plume rise due the plume's buoyancy).


=== Storage stability ===
[[File:Gaussian Plume.png|thumb|right|333px|Visualization of a buoyant Gaussian air pollutant dispersion plume]]
{{Image|E10 Water Tolerance.png|right|281px|Temperatures and associated water contents at which a blend of  gasoline and 10 volume % ethanol separates.}}


Gasoline is insoluble in water but ethanol and water are mutually soluble. Thus, end-product gasolines containing ethanol will, at certain temperatures and water concentrations, separate into a gasoline phase and an aqueous ethanol phase.<ref>[http://www.scribd.com/doc/1970087/Environmental-Protection-Agency-Ethanol-Workshop E10 & E85 and Other Alternate Fuels] Bruce Bauman, [[American Petroleum Institute]](API)</ref> For example, the adjacent graph shows the temperatures at which phase separation will occur in a gasoline containing 10 volume percent ethanol and as little as 0.2 to 0.5 volume percent water.  
To determine Δ''H'', many if not most of the air dispersion models developed between the late 1960s and the early 2000s used what are known as "the Briggs equations." G.A. Briggs first published his plume rise observations and comparisons in 1965.<ref>G.A. Briggs, "A plume rise model compared with observations", ''JAPCA'', 15:433–438, 1965.</ref> In 1968, at a symposium sponsored by CONCAWE (a Dutch organization), he compared many of the plume rise models then available in the literature.<ref>G.A. Briggs, "CONCAWE meeting: discussion of the comparative consequences of different plume rise formulas", ''Atmos. Envir.'', 2:228–232, 1968.</ref> In that same year, Briggs also wrote the section of the publication edited by Slade<ref>D.H. Slade (editor), "Meteorology and atomic energy 1968", Air Resources Laboratory, U.S. Dept. of Commerce, 1968.</ref> dealing with the comparative analyses of plume rise models.  That was followed in 1969 by his classical critical review of the entire plume rise literature,<ref>G.A. Briggs, "Plume Rise", ''USAEC Critical Review Series'', 1969.</ref> in which he proposed a set of plume rise equations which have become widely known as "the Briggs equations".  Subsequently, Briggs modified his 1969 plume rise equations in 1971 and in 1972.<ref>G.A. Briggs, "Some recent analyses of plume rise observation", ''Proc. Second Internat'l. Clean Air Congress'', Academic Press, New York, 1971.</ref><ref>G.A. Briggs, "Discussion: chimney plumes in neutral and stable surroundings", ''Atmos. Envir.'', 6:507–510, 1972.</ref>


Gasolines containing less than 10 volume percent ethanol will experience phase separation more easily, meaning that phase separation will occur at higher temperatures and even lower water contents. Gasolines containing more than 10 volume percent ethanol will experience phase separation less easily meaning that the separation will occur at lower temperatures and  higher concentration.
Briggs divided air pollution plumes into these four general categories:
* Cold jet plumes in calm ambient air conditions
* Cold jet plumes in windy ambient air conditions
* Hot, buoyant plumes in calm ambient air conditions
* Hot, buoyant plumes in windy ambient air conditions


Gasoline stored in fuel tanks and other containers will, in time, undergo [[oxidation|oxidative degradation]] and form sticky resins referred to as ''gums''. Such gums can precipitate out of the gasoline and cause fouling of the various components of internal combustion engines which reduces the performance of the engines and also makes it harder to start them. Relatively small amounts of various anti-oxidation additives are included in end-product gasoline to improve the gasoline stability during storage by inhibiting the formation of gums.
Briggs considered the trajectory of cold jet plumes to be dominated by their initial velocity momentum, and the trajectory of hot, buoyant plumes to be dominated by their buoyant momentum to the extent that their initial velocity momentum was relatively unimportant. Although Briggs proposed plume rise equations for each of the above plume categories, '''''it is important to emphasize that "the Briggs equations" which become widely used are those that he proposed for bent-over, hot buoyant plumes'''''.


Other additives are also provided in end-product gasolines, such as corrosion inhibitors to protect gasoline storage tanks, freezing point depressants to prevent icing, and color dyes for safety or governmental regulatory requirements.<ref name=FAQ/><ref name=Assi/><ref name=Jones>{{cite book|author=David S.J. Jones and Peter P. Pujado (Editors)|title=Handbook of Petroleum Processing|edition=First Edition|publisher=Springer|year=2006|id=ISBN 1-4020-2819-9}}</ref>
In general, Briggs's equations for bent-over, hot buoyant plumes are based on observations and data involving plumes from typical combustion sources such as the flue gas stacks from steam-generating boilers burning fossil fuels in large power plants.  Therefore the stack exit velocities were probably in the range of 20 to 100 ft/s (6 to 30 m/s) with exit temperatures ranging from 250 to 500 °F (120 to 260 °C).
 
== Other octane enhancers ==


A logic diagram for using the Briggs equations<ref name=Beychok/> to obtain the plume rise trajectory of bent-over buoyant plumes is presented below:
[[Image:BriggsLogic.png|none]]
:{| border="0" cellpadding="2"
|-
|align=right|where:
|&nbsp;
|-
!align=right| Δh
|align=left|= plume rise, in m
|-
!align=right| F<sup>&nbsp;</sup> <!-- The HTML is needed to line up characters. Do not remove.-->
|align=left|= buoyancy factor, in m<sup>4</sup>s<sup>−3</sup>
|-
!align=right| x
|align=left|= downwind distance from plume source, in m
|-
!align=right| x<sub>f</sub>
|align=left|= downwind distance from plume source to point of maximum plume rise, in m
|-
!align=right| u
|align=left|= windspeed at actual stack height, in m/s
|-
!align=right| s<sup>&nbsp;</sup> <!-- The HTML is needed to line up characters. Do not remove.-->
|align=left|= stability parameter, in s<sup>−2</sup>
|}
The above parameters used in the Briggs' equations are discussed in Beychok's book.<ref name=Beychok/>


== References ==
==References==
{{reflist}}
{{reflist}}


== Further reading==


== External links ==
*{{cite book | author=M.R. Beychok| title=Fundamentals Of Stack Gas Dispersion | edition=4th Edition | publisher=author-published | year=2005 | isbn=0-9644588-0-2}}


* [http://cta.ornl.gov/data/index.shtml Transportation Energy Data Book]
*{{cite book | author=K.B. Schnelle and P.R. Dey| title=Atmospheric Dispersion Modeling Compliance Guide  | edition=1st Edition| publisher=McGraw-Hill Professional | year=1999 | isbn=0-07-058059-6}}


*{{cite book | author=D.B. Turner| title=Workbook of Atmospheric Dispersion Estimates: An Introduction to Dispersion Modeling | edition=2nd Edition | publisher=CRC Press | year=1994 | isbn=1-56670-023-X}}


==Possible references==
*{{cite book | author= S.P. Arya| title=Air Pollution Meteorology and Dispersion | edition=1st Edition | publisher=Oxford University Press | year=1998 | isbn=0-19-507398-3}}


*{{cite book|author=John McKetta (Editor)|title=Petroleum Processing Handbook|edition=|publisher=CRC Press|year=1992|id=ISBN 0-8247-8681-5}}
*{{cite book | author=R. Barrat| title=Atmospheric Dispersion Modelling | edition=1st Edition | publisher=Earthscan Publications | year=2001 | isbn=1-85383-642-7}}


*[http://www.med.govt.nz/templates/Page____10323.aspx Questions and Answers Relating to the Review of the Existing Fuel Quality Regulations], New Zealand Ministry of Economic Development, December 2005.
*{{cite book | author=S.R. Hanna and R.E. Britter| title=Wind Flow and Vapor Cloud Dispersion at Industrial and Urban Sites  | edition=1st Edition | publisher=Wiley-American Institute of Chemical Engineers | year=2002 | isbn=0-8169-0863-X}}


*[http://techni.tachemie.uni-leipzig.de/otto/otto_g0_eng.html Otto Cycle] (About the [[Internal combustion engine|internal combustion engine]] [[Four-stroke cycle|four-stroke cycle]] invented by [[Nicolaus August Otto|Nicolaus A. Otto]])
*{{cite book | author=P. Zannetti| title=Air pollution modeling : theories, computational methods, and available software | edition= | publisher= Van Nostrand Reinhold | year=1990 | isbn=0-442-30805-1 }}

Latest revision as of 04:25, 22 November 2023


The account of this former contributor was not re-activated after the server upgrade of March 2022.


Industrial air pollution source

Atmospheric dispersion modeling is the mathematical simulation of how air pollutants disperse in the ambient atmosphere. It is performed with computer programs that solve the mathematical equations and algorithms which simulate the pollutant dispersion. The dispersion models are used to estimate or to predict the downwind concentration of air pollutants emitted from sources such as industrial plants, vehicular traffic or accidental chemical releases.

Such models are important to governmental agencies tasked with protecting and managing the ambient air quality. The models are typically employed to determine whether existing or proposed new industrial facilities are or will be in compliance with the National Ambient Air Quality Standards (NAAQS) in the United States or similar regulations in other nations. The models also serve to assist in the design of effective control strategies to reduce emissions of harmful air pollutants. During the late 1960's, the Air Pollution Control Office of the U.S. Environmental Protection Agency (U.S. EPA) initiated research projects to develop models for use by urban and transportation planners.[1]

Air dispersion models are also used by emergency management personnel to develop emergency plans for accidental chemical releases. The results of dispersion modeling, using worst case accidental releases and meteorological conditions, can provide estimated locations of impacted areas and be used to determine appropriate protective actions. At industrial facilities in the United States, this type of consequence assessment or emergency planning is required under the Clean Air Act (CAA) codified in Part 68 of Title 40 of the Code of Federal Regulations.

The dispersion models vary depending on the mathematics used to develop the model, but all require the input of data that may include:

  • Meteorological conditions such as wind speed and direction, the amount of atmospheric turbulence (as characterized by what is called the "stability class"), the ambient air temperature, the height to the bottom of any inversion aloft that may be present, cloud cover and solar radiation.
  • The emission parameters such the type of source (i.e., point, line or area), the mass flow rate, the source location and height, the source exit velocity, and the source exit temperature.
  • Terrain elevations at the source location and at receptor locations, such as nearby homes, schools, businesses and hospitals.
  • The location, height and width of any obstructions (such as buildings or other structures) in the path of the emitted gaseous plume as well as the terrain surface roughness (which may be characterized by the more generic parameters "rural" or "city" terrain).

Many of the modern, advanced dispersion modeling programs include a pre-processor module for the input of meteorological and other data, and many also include a post-processor module for graphing the output data and/or plotting the area impacted by the air pollutants on maps. The plots of areas impacted usually include isopleths showing areas of pollutant concentrations that define areas of the highest health risk. The isopleths plots are useful in determining protective actions for the public and first responders.

The atmospheric dispersion models are also known as atmospheric diffusion models, air dispersion models, air quality models, and air pollution dispersion models.

Atmospheric layers

Discussion of the layers in the Earth's atmosphere is needed to understand where airborne pollutants disperse in the atmosphere. The layer closest to the Earth's surface is known as the troposphere. It extends from sea-level up to a height of about 18 km and contains about 80 percent of the mass of the overall atmosphere. The stratosphere is the next layer and extends from 18 km up to about 50 km. The third layer is the mesosphere which extends from 50 km up to about 80 km. There are other layers above 80 km, but they are insignificant with respect to atmospheric dispersion modeling.

The lowest part of the troposphere is called the atmospheric boundary layer (ABL) or the planetary boundary layer (PBL) and extends from the Earth's surface up to about 1.5 to 2.0 km in height. The air temperature of the atmospheric boundary layer decreases with increasing altitude until it reaches what is called the inversion layer (where the temperature increases with increasing altitude) that caps the atmospheric boundary layer. The upper part of the troposphere (i.e., above the inversion layer) is called the free troposphere and it extends up to the 18 km height of the troposphere.

The ABL is the most important layer with respect to the emission, transport and dispersion of airborne pollutants. The part of the ABL between the Earth's surface and the bottom of the inversion layer is known as the mixing layer. Almost all of the airborne pollutants emitted into the ambient atmosphere are transported and dispersed within the mixing layer. Some of the emissions penetrate the inversion layer and enter the free troposphere above the ABL.

In summary, the layers of the Earth's atmosphere from the surface of the ground upwards are: the ABL made up of the mixing layer capped by the inversion layer; the free troposphere; the stratosphere; the mesosphere and others. Many atmospheric dispersion models are referred to as boundary layer models because they mainly model air pollutant dispersion within the ABL. To avoid confusion, models referred to as mesoscale models have dispersion modeling capabilities that can extend horizontally as much as a few hundred kilometres. It does not mean that they model dispersion in the mesosphere.

Gaussian air pollutant dispersion equation

The technical literature on air pollution dispersion is quite extensive and dates back to the 1930s and earlier. One of the early air pollutant plume dispersion equations was derived by Bosanquet and Pearson.[2] Their equation did not assume Gaussian distribution nor did it include the effect of ground reflection of the pollutant plume.

Sir Graham Sutton derived an air pollutant plume dispersion equation in 1947[3][4] which did include the assumption of Gaussian distribution for the vertical and crosswind dispersion of the plume and also included the effect of ground reflection of the plume.

Under the stimulus provided by the advent of stringent environmental control regulations, there was an immense growth in the use of air pollutant plume dispersion calculations between the late 1960s and today. A great many computer programs for calculating the dispersion of air pollutant emissions were developed during that period of time and they were commonly called "air dispersion models". The basis for most of those models was the Complete Equation For Gaussian Dispersion Modeling Of Continuous, Buoyant Air Pollution Plumes shown below:[5][6]


where:  
= crosswind dispersion parameter
  =
= vertical dispersion parameter =
= vertical dispersion with no reflections
  =
= vertical dispersion for reflection from the ground
  =
= vertical dispersion for reflection from an inversion aloft
  =
           
           
           
= concentration of emissions, in g/m³, at any receptor located:
            x meters downwind from the emission source point
            y meters crosswind from the emission plume centerline
            z meters above ground level
= source pollutant emission rate, in g/s
= horizontal wind velocity along the plume centerline, m/s
= height of emission plume centerline above ground level, in m
= vertical standard deviation of the emission distribution, in m
= horizontal standard deviation of the emission distribution, in m
= height from ground level to bottom of the inversion aloft, in m
= the exponential function

The above equation not only includes upward reflection from the ground, it also includes downward reflection from the bottom of any inversion lid present in the atmosphere.

The sum of the four exponential terms in converges to a final value quite rapidly. For most cases, the summation of the series with m = 1, m = 2 and m = 3 will provide an adequate solution.

and are functions of the atmospheric stability class (i.e., a measure of the turbulence in the ambient atmosphere) and of the downwind distance to the receptor. The two most important variables affecting the degree of pollutant emission dispersion obtained are the height of the emission source point and the degree of atmospheric turbulence. The more turbulence, the better the degree of dispersion.

Whereas older models rely on stability classes for the determination of and , more recent models increasingly rely on Monin-Obukhov similarity theory to derive these parameters.

Briggs plume rise equations

The Gaussian air pollutant dispersion equation (discussed above) requires the input of H which is the pollutant plume's centerline height above ground level. H is the sum of Hs (the actual physical height of the pollutant plume's emission source point) plus ΔH (the plume rise due the plume's buoyancy).

Visualization of a buoyant Gaussian air pollutant dispersion plume

To determine ΔH, many if not most of the air dispersion models developed between the late 1960s and the early 2000s used what are known as "the Briggs equations." G.A. Briggs first published his plume rise observations and comparisons in 1965.[7] In 1968, at a symposium sponsored by CONCAWE (a Dutch organization), he compared many of the plume rise models then available in the literature.[8] In that same year, Briggs also wrote the section of the publication edited by Slade[9] dealing with the comparative analyses of plume rise models. That was followed in 1969 by his classical critical review of the entire plume rise literature,[10] in which he proposed a set of plume rise equations which have become widely known as "the Briggs equations". Subsequently, Briggs modified his 1969 plume rise equations in 1971 and in 1972.[11][12]

Briggs divided air pollution plumes into these four general categories:

  • Cold jet plumes in calm ambient air conditions
  • Cold jet plumes in windy ambient air conditions
  • Hot, buoyant plumes in calm ambient air conditions
  • Hot, buoyant plumes in windy ambient air conditions

Briggs considered the trajectory of cold jet plumes to be dominated by their initial velocity momentum, and the trajectory of hot, buoyant plumes to be dominated by their buoyant momentum to the extent that their initial velocity momentum was relatively unimportant. Although Briggs proposed plume rise equations for each of the above plume categories, it is important to emphasize that "the Briggs equations" which become widely used are those that he proposed for bent-over, hot buoyant plumes.

In general, Briggs's equations for bent-over, hot buoyant plumes are based on observations and data involving plumes from typical combustion sources such as the flue gas stacks from steam-generating boilers burning fossil fuels in large power plants. Therefore the stack exit velocities were probably in the range of 20 to 100 ft/s (6 to 30 m/s) with exit temperatures ranging from 250 to 500 °F (120 to 260 °C).

A logic diagram for using the Briggs equations[5] to obtain the plume rise trajectory of bent-over buoyant plumes is presented below:

BriggsLogic.png
where:  
Δh = plume rise, in m
F  = buoyancy factor, in m4s−3
x = downwind distance from plume source, in m
xf = downwind distance from plume source to point of maximum plume rise, in m
u = windspeed at actual stack height, in m/s
s  = stability parameter, in s−2

The above parameters used in the Briggs' equations are discussed in Beychok's book.[5]

References

  1. J.C. Fensterstock et al, "Reduction of air pollution potential through environmental planning", JAPCA, Vol. 21, No. 7, 1971.
  2. C.H. Bosanquet and J.L. Pearson, "The spread of smoke and gases from chimneys", Trans. Faraday Soc., 32:1249, 1936.
  3. O.G. Sutton, "The problem of diffusion in the lower atmosphere", QJRMS, 73:257, 1947.
  4. O.G. Sutton, "The theoretical distribution of airborne pollution from factory chimneys", QJRMS, 73:426, 1947.
  5. 5.0 5.1 5.2 M.R. Beychok (2005). Fundamentals Of Stack Gas Dispersion, 4th Edition. author-published. ISBN 0-9644588-0-2. .
  6. D. B. Turner (1994). Workbook of atmospheric dispersion estimates: an introduction to dispersion modeling, 2nd Edition. CRC Press. ISBN 1-56670-023-X. .
  7. G.A. Briggs, "A plume rise model compared with observations", JAPCA, 15:433–438, 1965.
  8. G.A. Briggs, "CONCAWE meeting: discussion of the comparative consequences of different plume rise formulas", Atmos. Envir., 2:228–232, 1968.
  9. D.H. Slade (editor), "Meteorology and atomic energy 1968", Air Resources Laboratory, U.S. Dept. of Commerce, 1968.
  10. G.A. Briggs, "Plume Rise", USAEC Critical Review Series, 1969.
  11. G.A. Briggs, "Some recent analyses of plume rise observation", Proc. Second Internat'l. Clean Air Congress, Academic Press, New York, 1971.
  12. G.A. Briggs, "Discussion: chimney plumes in neutral and stable surroundings", Atmos. Envir., 6:507–510, 1972.

Further reading

  • M.R. Beychok (2005). Fundamentals Of Stack Gas Dispersion, 4th Edition. author-published. ISBN 0-9644588-0-2. 
  • K.B. Schnelle and P.R. Dey (1999). Atmospheric Dispersion Modeling Compliance Guide, 1st Edition. McGraw-Hill Professional. ISBN 0-07-058059-6. 
  • D.B. Turner (1994). Workbook of Atmospheric Dispersion Estimates: An Introduction to Dispersion Modeling, 2nd Edition. CRC Press. ISBN 1-56670-023-X. 
  • S.P. Arya (1998). Air Pollution Meteorology and Dispersion, 1st Edition. Oxford University Press. ISBN 0-19-507398-3. 
  • R. Barrat (2001). Atmospheric Dispersion Modelling, 1st Edition. Earthscan Publications. ISBN 1-85383-642-7. 
  • S.R. Hanna and R.E. Britter (2002). Wind Flow and Vapor Cloud Dispersion at Industrial and Urban Sites, 1st Edition. Wiley-American Institute of Chemical Engineers. ISBN 0-8169-0863-X. 
  • P. Zannetti (1990). Air pollution modeling : theories, computational methods, and available software. Van Nostrand Reinhold. ISBN 0-442-30805-1.