Volatility of organic molecular markers used for source apportionment analysis: Measurements and implications for atmospheric lifetime

Environmental Science and Technology

Volumn 46, Issue 22, 2012, Pages 12435-12444

  May, Andrew A ^a   Saleh, Rawad ^a   Hennigan, Christopher J ^a   Donahue, Neil M ^a   Robinson, Allen L ^a  

^a CARNEGIE MELLON UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ATMOSPHERIC CONDITIONS; ATMOSPHERIC LIFETIME; BIOMASS-BURNING; CHEMICAL KINETICS MODEL; CORONENE; ENTHALPIES OF VAPORIZATION; FINE PARTICULATE MATTER; GAS PHASE OXIDATION; GAS-PARTICLE PARTITIONING; GASPHASE; LEVOGLUCOSAN; MOLECULAR MARKER; MOTOR VEHICLE; NON-VOLATILE COMPOUNDS; ORGANIC SPECIES; RECEPTOR MODEL; SATURATION CONCENTRATION; SEMIVOLATILE COMPOUNDS; SINGLE COMPONENTS; SOURCE APPORTIONMENT; VOLUME METHOD;

EVAPORATION; OLEIC ACID; PHASE TRANSITIONS;

THERMAL PROCESSING (FOODS);

ANTHRACENE; CHOLESTANE DERIVATIVE; CHOLESTEROL; CORONENE; LEVOGLUCOSAN; MOLECULAR MARKER; OLEIC ACID; VOLATILE AGENT;

ATMOSPHERIC POLLUTION; MOLECULAR ANALYSIS; PARTICULATE MATTER; POLLUTANT SOURCE; VOLATILE ORGANIC COMPOUND;

ARTICLE; ATMOSPHERIC DISPERSION; BIOMASS; CHEMICAL REACTION KINETICS; ENTHALPY; ENVIRONMENTAL TEMPERATURE; EVAPORATION; GAS; MEASUREMENT; MEAT; MOTOR VEHICLE; OXIDATION; PARTICULATE MATTER; QUANTITATIVE ANALYSIS; VAPORIZATION;

AIR POLLUTANTS; BIOMASS; COOKING; ENVIRONMENTAL MONITORING; FIRES; MODELS, THEORETICAL; ORGANIC CHEMICALS; PARTICULATE MATTER; THERMODYNAMICS; VEHICLE EMISSIONS; VOLATILIZATION;

EID: 84869399975     PISSN: 0013936X     EISSN: 15205851     Source Type: Journal    
DOI: 10.1021/es302276t     Document Type: Article

References (60)

1. Schauer, J. J.; Rogge, W. F.; Hildemann, L. M.; Mazurek, M. A.; Cass, G. R.; Simoneit, B. R. T. Source apportionment of airborne particulate matter using organic compounds as tracers Atmos. Environ. 1996, 30 (22) 3837-3855
2. Robinson, A. L.; Donahue, N. M.; Rogge, W. F. Photochemical oxidation and changes in molecular composition of organic aerosol in the regional context. J. Geophys. Res.-Atmos. 2006, 111, (D3).
3. Sihabut, T.; Ray, J.; Northcross, A.; McDow, S. R. Sampling artifact estimates for alkanes, hopanes, and aliphatic carboxylic acids Atmos. Environ. 2005, 39 (37) 6945-6956
4. Ruehl, C. R.; Ham, W. A.; Kleeman, M. J. Temperature-induced volatility of molecular markers in ambient airborne particulate matter Atmos. Chem. Phys. 2011, 11 (1) 67-76
5. Booth, A. M.; Montague, W. J.; Barley, M. H.; Topping, D. O.; McFiggans, G.; Garforth, A.; Percival, C. J. Solid state and sub-cooled liquid vapour pressures of cyclic aliphatic dicarboxylic acids Atmos. Chem. Phys. 2011, 11 (2) 655-665
6. Cappa, C. D.; Lovejoy, E. R.; Ravishankara, A. R. Evaporation rates and vapor pressures of the even-nunibered C(8)-C(18) monocarboxylic acids J. Phys. Chem. A 2008, 112 (17) 3959-3964
7. Chickos, J. S.; Webb, P.; Nichols, G.; Kiyobayashi, T.; Cheng, P. C.; Scott, L. The enthalpy of vaporization and sublimation of corannulene, coronene, and perylene at T=298.15 K J. Chem. Thermodyn. 2002, 34 (8) 1195-1206 (Pubitemid 35262786)
8. Hanshaw, W.; Nutt, M.; Chickos, J. S. Hypothetical thermodynamic properties. Subcooled vaporization enthalpies and vapor pressures of polyaromatic hydrocarbons J. Chem. Eng. Data 2008, 53 (8) 1903-1913
9. Lei, Y. D.; Chankalal, R.; Chan, A.; Wania, F. Supercooled liquid vapor pressures of the polycyclic aromatic hydrocarbons J. Chem. Eng. Data 2002, 47 (4) 801-806 (Pubitemid 34822381)
10. Mokbel, I.; Ruzicka, K.; Majer, V.; Ruzicka, V.; Ribeiro, M.; Jose, J.; Zabransky, M. Vapor pressures and thermal data for three high-boiling compounds of petroleum interest: 1-phenyldodecane, (5 alpha)-cholestane, adamantane Fluid Phase Equilib. 2000, 169 (2) 191-207 (Pubitemid 32472238)
11. Nichols, G.; Kweskin, S.; Frericks, M.; Reiter, S.; Wang, G.; Orf, J.; Carvallo, B.; Hillesheim, D.; Chickos, J. Evaluation of the vaporization, fusion, and sublimation enthalpies of the 1-alkanols: The vaporization enthalpy of 1-, 6-, 7-, and 9-heptadecanol, 1-octadecanol, 1-eicosanol, 1-docosanol, 1-hexacosanol, and cholesterol at T 298.15 K by correlation gas chromatography J. Chem. Eng. Data 2006, 51 (2) 475-482
12. Oja, V.; Chen, X.; Hajaligol, M. R.; Chan, W. G. Sublimation Thermodynamic Parameters for Cholesterol, Ergosterol, beta-Sitosterol, and Stigmasterol J. Chem. Eng. Data 2009, 54 (3) 730-734
13. Oja, V.; Suuberg, E. M. Vapor pressures and enthalpies of sublimation of d -glucose, d -xylose, cellobiose, and levoglucosan J. Chem. Eng. Data 1999, 44 (1) 26-29
14. Tang, I. N.; Munkelwitz, H. R. Determination of Vapor-Pressure from Droplet Evaporation Kinetics J. Colloid Interface Sci. 1991, 141 (1) 109-118
15. Rudich, Y.; Donahue, N. M.; Mentel, T. F. Aging of organic aerosol: Bridging the gap between laboratory and field studies Annu. Rev. Phys. Chem. 2007, 58, 321-352 (Pubitemid 46877593)
16. Hennigan, C. J.; Sullivan, A. P.; Collett, J. L.; Robinson, A. L. Levoglucosan stability in biomass burning particles exposed to hydroxyl radicals. Geophys. Res. Lett. 2010, 37.
17. Lambe, A. T.; Miracolo, M. A.; Hennigan, C. J.; Robinson, A. L.; Donahue, N. M. Effective Rate Constants and Uptake Coefficients for the Reactions of Organic Molecular Markers (n-Alkanes, Hopanes, and Steranes) in Motor Oil and Diesel Primary Organic Aerosols with Hydroxyl Radicals Environ. Sci. Technol. 2009, 43 (23) 8794-8800
18. Weitkamp, E. A.; Hartz, K. E. H.; Sage, A. M.; Donahue, N. M.; Robinson, A. L. Laboratory measurements of the heterogeneous oxidation of condensed-phase organic molecular makers for meat cooking emissions Environ. Sci. Technol. 2008, 42 (14) 5177-5182
19. Weitkamp, E. A.; Lambe, A. T.; Donahue, N. M.; Robinson, A. L. Laboratory Measurements of the Heterogeneous Oxidation of Condensed-Phase Organic Molecular Makers for Motor Vehicle Exhaust Environ. Sci. Technol. 2008, 42 (21) 7950-7956
20. Saleh, R.; Walker, J.; Khlystov, A. Determination of saturation pressure and enthalpy of vaporization of semi-volatile aerosols: The integrated volume method J. Aerosol Sci. 2008, 39 (10) 876-887
21. Veranth, J. M.; Gelein, R.; Oberdorster, G. Vaporization-condensation generation of ultrafine hydrocarbon particulate matter for inhalation toxicology studies Aerosol Sci. Technol. 2003, 37 (7) 603-609 (Pubitemid 36712598)
22. Saleh, R.; Khlystov, A.; Shihadeh, A. Effect of Aerosol Generation Method on Measured Saturation Pressure and Enthalpy of Vaporization for Dicarboxylic Acid Aerosols Aerosol Sci. Technol. 2010, 44 (4) 302-307
23. Yaws, C. L. Yaws Critical Property Data for Chemical Engineers and Chemists; Knovel, 2012.
24. Riipinen, I.; Pierce, J. R.; Donahue, N. M.; Pandis, S. N. Equilibration time scales of organic aerosol inside thermodenuders: Evaporation kinetics versus thermodynamics Atmos. Environ. 2010, 44 (5) 597-607
25. Saleh, R.; Shihadeh, A.; Khlystov, A. On transport phenomena and equilibration time scales in thermodenuders Atmos. Meas. Tech. 2011, 4 (3) 571-581
26. Chickos, J. S.; Hanshaw, W. Vapor pressures and vaporization enthalpies of the n-alkanes from C-31 to C-38 at T=298.15 K by correlation gas chromatography J. Chem. Eng. Data 2004, 49 (3) 620-630
27. Chickos, J. S.; Hanshaw, W. Vapor pressures and vaporization enthalpies of the n-alkanes from C-21 to C-30 at T=298.15 K by correlation gas chromatography J. Chem. Eng. Data 2004, 49 (1) 77-85
28. Morgan, D. L.; Kobayashi, R. Direct Vapor-Pressure Measurements of 10 N-Alkanes in the C-10-C(28) Range Fluid Phase Equilib. 1994, 97, 211-242
29. McCabe, C.; Jackson, G. SAFT-VR modelling of the phase equilibrium of long-chain n-alkanes Phys. Chem. Chem. Phys. 1999, 1 (9) 2057-2064
30. Sasse, K.; Jose, J.; Merlin, J. C. A Static Apparatus for Measurement of Low Vapor-Pressures-Experimental Results on High Molecular-Weight Hydrocarbons Fluid Phase Equilib. 1988, 42, 287-304
31. Piacente, V.; Fontana, D.; Scardala, P. Enthalpies of Vaporization of a Homologous Series of N-Alkanes Determined from Vapor-Pressure Measurements J. Chem. Eng. Data 1994, 39 (2) 231-237
32. Donahue, N. M.; Epstein, S. A.; Pandis, S. N.; Robinson, A. L. A two-dimensional volatility basis set: 1. organic-aerosol mixing thermodynamics Atmos. Chem. Phys. 2011, 11 (7) 3303-3318
33. Donahue, N. M.; Robinson, A. L.; Stanier, C. O.; Pandis, S. N. Coupled partitioning, dilution, and chemical aging of semivolatile organics Environ. Sci. Technol. 2006, 40 (8) 2635-2643
34. Safieddine, S. Experimental Validation of an Integrated Volume-Tandem Differential Mobility Analysis Method for Determining Thermodynamic and Kinetic Properties of Semi-Volatile Organic Aerosols; American University of Beiruit, 2011.
35. Rader, D. J.; McMurry, P. H.; Smith, S. Evaporation Rates of Monodisperse Organic Aerosols in the 0.02-Mu-M-Diameter to 0.2-Mu-M-Diameter Range Aerosol Sci. Technol. 1987, 6 (3) 247-260 (Pubitemid 17598250)
36. Oja, V.; Suuberg, E. M. Vapor pressures and enthalpies of sublimation of polycyclic aromatic hydrocarbons and their derivatives J. Chem. Eng. Data 1998, 43 (3) 486-492 (Pubitemid 128594275)
37. Wakayama, N.; Inokuchi, H. Heats of Sublimation of Polycyclic Aromatic Hydrocarbons and Their Molecular Packings Bull. Chem. Soc. Jpn. 1967, 40 (10) 2267
38. Grieshop, A. P.; Donahue, N. M.; Robinson, A. L. Laboratory investigation of photochemical oxidation of organic aerosol from wood fires 2: Analysis of aerosol mass spectrometer data Atmos. Chem. Phys. 2009, 9 (6) 2227-2240
39. Huffman, J. A.; Docherty, K. S.; Mohr, C.; Cubison, M. J.; Ulbrich, I. M.; Ziemann, P. J.; Onasch, T. B.; Jimenez, J. L. Chemically-Resolved Volatility Measurements of Organic Aerosol from Different Sources Environ. Sci. Technol. 2009, 43 (14) 5351-5357
40. Hennigan, C. J.; Miracolo, M. A.; Engelhart, G. J.; May, A. A.; Presto, A. A.; Lee, T.; Sullivan, A. P.; McMeeking, G. R.; Coe, H.; Wold, C. E.; Hao, W. M.; Gilman, J. B.; Kuster, W. C.; de Gouw, J.; Schichtel, B. A.; Collett, J. L.; Kreidenweis, S. M.; Robinson, A. L. Chemical and physical transformations of organic aerosol from the photo-oxidation of open biomass burning emissions in an environmental chamber Atmos. Chem. Phys. 2011, 11 (15) 7669-7686
41. Lee, T.; Sullivan, A. P.; Mack, L.; Jimenez, J. L.; Kreidenweis, S. M.; Onasch, T. B.; Worsnop, D. R.; Malm, W.; Wold, C. E.; Hao, W. M.; Collett, J. L. Chemical Smoke Marker Emissions During Flaming and Smoldering Phases of Laboratory Open Burning of Wildland Fuels Aerosol Sci. Technol. 2010, 44 (9) I-V
42. Grieshop, A. P.; Miracolo, M. A.; Donahue, N. M.; Robinson, A. L. Constraining the Volatility Distribution and Gas-Particle Partitioning of Combustion Aerosols Using Isothermal Dilution and Thermodenuder Measurements Environ. Sci. Technol. 2009, 43 (13) 4750-4756
43. Ziemann, P. J.; Faulhaber, A.; Huffman, J. A.; Lechner, M. J.; Jimenez, J. L. Combined Mass Spectra-Volatility Database. http://cires.colorado.edu/ jimenez-group/TDPBMSsd/.
44. Cubison, M. J.; Ortega, A. M.; Hayes, P. L.; Farmer, D. K.; Day, D.; Lechner, M. J.; Brune, W. H.; Apel, E.; Diskin, G. S.; Fisher, J. A.; Fuelberg, H. E.; Hecobian, A.; Knapp, D. J.; Mikoviny, T.; Riemer, D.; Sachse, G. W.; Sessions, W.; Weber, R. J.; Weinheimer, A. J.; Wisthaler, A.; Jimenez, J. L. Effects of aging on organic aerosol from open biomass burning smoke in aircraft and laboratory studies Atmos. Chem. Phys. 2011, 11 (23) 12049-12064
45. Seinfeld, J. H.; Pandis, S. N. Atmospheric Chemistry and Physics from Air Pollution to Climate Change
46. 2 nd ed.; J. Wiley: Hoboken, NJ, 2006; pp xxviii, 1203 pp.
47. Bertram, A. K.; Ivanov, A. V.; Hunter, M.; Molina, L. T.; Molina, M. J. The reaction probability of OH on organic surfaces of tropospheric interest J. Phys. Chem. A 2001, 105 (41) 9415-9421
48. Worsnop, D. R.; Morris, J. W.; Shi, Q.; Davidovits, P.; Kolb, C. E. A chemical kinetic model for reactive transformations of aerosol particles Geophys. Res. Lett. 2002, 29, 20
49. Kwok, E. S. C.; Atkinson, R. Estimation of Hydroxyl Radical Reaction-Rate Constants for Gas-Phase Organic-Compounds Using a Structure-Reactivity Relationship-an Update Atmos. Environ. 1995, 29 (14) 1685-1695 (Pubitemid 26436793)
50. Goldstein, A. H.; Galbally, I. E. Known and unexplored organic constituents in the earths atmosphere Environ. Sci. Technol. 2007, 41 (5) 1514-1521 (Pubitemid 46362448)
51. Zuend, A.; Marcolli, C.; Booth, A. M.; Lienhard, D. M.; Soonsin, V.; Krieger, U. K.; Topping, D. O.; McFiggans, G.; Peter, T.; Seinfeld, J. H. New and extended parameterization of the thermodynamic model AIOMFAC: Calculation of activity coefficients for organic-inorganic mixtures containing carboxyl, hydroxyl, carbonyl, ether, ester, alkenyl, alkyl, and aromatic functional groups Atmos. Chem. Phys. 2011, 11 (17) 9155-9206
52. Zuend, A.; Marcolli, C.; Luo, B. P.; Peter, T. A thermodynamic model of mixed organic-inorganic aerosols to predict activity coefficients Atmos. Chem. Phys. 2008, 8 (16) 4559-4593
53. Aerosol Inorganic-Organic Mixtures Functional groups Activity Coefficients Model. http://www.aiomfac.caltech.edu.
54. Subramanian, R.; Donahue, N. M.; Bernardo-Bricker, A.; Rogge, W. F.; Robinson, A. L. Insights into the primary-secondary and regional-local contributions to organic aerosol and PM2.5 mass in Pittsburgh, Pennsylvania Atmos. Environ. 2007, 41 (35) 7414-7433 (Pubitemid 350052650)
55. Accardi-Dey, A.; Gschwend, P. M. Reinterpreting literature sorption data considering both absorption into organic carbon and adsorption onto black carbon Environ. Sci. Technol. 2003, 37 (1) 99-106 (Pubitemid 36043506)
56. Dachs, J.; Eisenreich, S. J. Adsorption onto aerosol soot carbon dominates gas-particle partitioning of polycyclic aromatic hydrocarbons Environ. Sci. Technol. 2000, 34 (17) 3690-3697
57. Robinson, A. L.; Grieshop, A. P.; Donahue, N. M.; Hunt, S. W. Updating the Conceptual Model for Fine Particle Mass Emissions from Combustion Systems J. Air Waste Manage. 2010, 60 (10) 1204-1222
58. Simoneit, B. R. T.; Schauer, J. J.; Nolte, C. G.; Oros, D. R.; Elias, V. O.; Fraser, M. P.; Rogge, W. F.; Cass, G. R. Levoglucosan, a tracer for cellulose in biomass burning and atmospheric particles Atmos. Environ. 1999, 33 (2) 173-182 (Pubitemid 28561853)
59. Rogge, W. F.; Hildemann, L. M.; Mazurek, M. A.; Cass, G. R.; Simoneit, B. R. T. Sources of fine organic aerosol. 1. Charbroilers and meat cooking operations Environ. Sci. Technol. 1991, 25 (6) 1112-1125
60. Rogge, W. F.; Hildemann, L. M.; Mazurek, M. A.; Cass, G. R.; Simoneit, B. R. T. Sources of fine organic aerosol. 2. Noncatalyst and catalyst-equipped automobiles and heavy-duty diesel trucks Environ. Sci. Technol. 1993, 27 (4) 636-651 (Pubitemid 23129294)