United States
                    Environmental Protection
                    Agency
Environmental Sciences Research
Laboratory
Research Triangle Park NC 27711
                     Research and Development
EPA-600/S3-83-028  Sept. 1983
SEPA         Project  Summary

                    Nitrogen  Oxides  Reactions
                    Within  Urban  Plumes
                    Transported  Over  the  Ocean
                    Chester W. Spicer, John R.  Koetz, G. William Keigley, George M. Sverdrop,
                    and Gerald F. Ward
                      The rate of removal or conversion of
                    nitrogen oxides was determined from
                    airborne measurements  in the urban
                    plume of Boston. The mean pseudo-
                    first-order rate constant for removal
                    was 0.18 per hour, with a range of 0.14
                    to 0.24 per hour under daylight con-
                    ditions for four study days. The re-
                    moval process is dominated by chem-
                    ical conversion to  nitric acid and or-
                    ganic nitrates. The removal rate sug-
                    gests an atmospheric lifetime for nitro-
                    gen oxides of about five to six hours in
                    urban air.
                      This Project Summary was developed
                    by EPA's Environmental Sciences Re-
                    search Laboratory, Research Triangle
                    Park. NC, to announce key findings of
                    the research project that is fully docu-
                    mented in a separate report of the
                    same title (see Project Report ordering
                    information at back).

                    Introduction
                      Since the early 1970's interest in the
                    atmospheric reactions of sulfur and nitro-
                    gen pollutants has continually increased.
                    To date, sulfur  compounds have been
                    studied more thoroughly, especially in
                    terms of the rate of ambient-air trans-
                    formations; knowledge of the ambient-air
                    reactions of nitrogen oxides (NOX; defined
                    as NO + N02) has lagged.
                      The aspect  of atmospheric NOX chem-
                    istry that is least understood is the rate at
                    which NOX are transformed to products.
                    Few atmospheric studies have addressed
                    this problem  because of  the technical
                    difficulties involved.  Breeding and co-
                    workers (1) investigated the transforma-
                    tions of several pollutants around St. Louis.
Their results suggest a 2- to 4-h half-life
for NO in the St Louis plume,  but their
Nİ2 data are inconclusive. Thus, little was
learned about the important conversion of
NOX to products.,
  Spicer et al. (2) investigated the fate of
NOX  in  the St Louis  and Los Angeles
urban areas in 1973 to identify the major
NOX reaction products  and, to the extent
possible, to define the nitrogen  mass
balance. The experiment was not designed
to obtain data on conversion rates, but if
certain assumptions are accepted, a trans-
formation rate  of  0.10 ħ 0.05 h'1  is
consistent with the Los Angeles data. (The
quoted  value is in the form of a rate
constant Since it is calculated from an
average percent conversion divided by a
time  interval, it should  not be taken as a
true rate constant and does not imply first-
order kinetics.)
  Calvert (3)'used (LARP) data to estimate
the rate of NOX removal from Los Angeles
air. He calculated a (3.0 ħ 2.4)  x 10'4 ppm
min'1 rate of conversion to products that
were not detected  by  the LARP chemi-
luminescence monitors. This rate is some-
what higher than our measurements sug-
gest for conversion to all products under
moderate Los Angeles  smog conditions.
  In experiments downwind of Los Angeles
in 1 976, we observed lower-limit NOX
conversion rates of 0.02 to 0.16 h'1  in
ground-level and aircraft sampling. Typ-
ical rates were 0.05 to 0.10 h"1. Trans-
formation to peroxyacetyl  nitrate (PAN)
ranged from < 0.01 to 0.08 rr1.
  The Los Angeles conversion  rates are
generally higher than those observed in
Phoenix, Arizona, in 1977. Phoenix was
selected for study because it is an isolated

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source; thus, the NOX reactions could be
followed  downwind of the city, over the
desert, where complications due to fresh
IMOX and  tracer emissions were minimal.
The  Phoenix study was the first experi-
ment designed principally to .determine
NOX conversion rates. Based on the NOX
and  tracer concentration levels and  in-
strument  sensitivities,  NOX conversion
rates of 0.05  h"1  should have been de-
tectable around Phoenix. This conversion
rate was rarely exceeded, a puzzling result,
since it is inconsistent with the earlierfield
results in Los  Angeles  and the expecta-
tions derived from modeling and  smog-
chamber studies.
  While  much  has  been learned  of the
distribution, balance, and fate of oxidized
nitrogen  in urban atmospheres, this brief
review clearly indicates that  much un-
certainty remains regarding the rates of
NOX transformations in ambient air. The
few  measurements available of this con-
version rate cover a broad range and seem
to be city-specific.  To better understand
and model atmospheric NOX reactions and
to assess their impact on health, visibility,
and  precipitation chemistry, much more
exact NOX conversion rates must be known,
and the factors that affect these rates must
be identified.
  We were able to  accurately estimate
NOX lifetime  in polluted  urban air.  The
results of the experimental phase of the
program  and the details of the experi-
mental methods  are presented  m  this
project report.
  The aim of  the  Boston urban  plume
study from July 27 to August 30, 1978
was a better understanding of NOX reac-
tions and especially the NOX reaction rate
in polluted urban air.
  Aircraft field measurements were ob-
tained in the  Boston plume as  it was
transported eastward over the ocean. A
mobile laboratory located at the Beverly,
Massachusetts airport  provided  ground
support for the flight program and ob-
tained ground-level data on air quality and
meteorological conditions.

Project Description
  To better define the rates of NOX trans-
formations within  urban plumes in the
least ambiguous way, it was desirable that
the urban source be isolated so that down-
wind emissions into  the urban plume are
minimal.  The city must also be a strong
source of NOX, and the downwind terrain
should be relatively smooth.  Based on
these considerations, Boston was selected
for this study. The predominant summer
winds from the west and southwest take
the  city's polluted air eastward over the
ocean, where smooth terrain and minimal
fresh emissions are the rule. As a north-
eastern coastal city, Boston also contrasts
sharply  with the  hot, dry  Phoenix site
studied earlier.
  The field  experiment  was  conducted
fromjuly27 to August 30,1978. Atwin-
engirTe~research aircraft was used for con-
tinuous monitoring and sample collection
in the  Boston  urban plume. A  mobile
laboratory served  as ground support for
the aircraft  program and continuously
monitored ground-level  air quality and
meteorological conditions. The mobile lab
and aircraft were based at Beverly Airport,
in Beverly,  MA,  approximately 25  km
northeast of Boston.  Hourly meteorologi-
cal data from several eastern Massachu-
setts stations were obtained by telephone
several times each day and were used to
construct working  trajectories for Boston's
polluted morning  air mass. The morning
air mass was followed throughout the day
by three or more monitoring flights along
these trajectories. Data were collected
during  multiple traverses  of  the urban
plume on each flight to bracket the morning
air parcel. Thus, data on pollutant con-
centrations  within the air  parcel  were
obtained from early morning through late
afternoon. Transport out to ^150  km
from the source was investigated. Back-
ground pollutant concentrations were also
obtained. The variables measured during
aircraft operations included NOX,  ozone
(O3), nitric acid (HON02), PAN,  carbon
monoxide (CO), nonmethane hydrocarbons
(NMHC), fluorotrichloromethane  (F-11),
to G! to GS  hydrocarbons, condensation
nuclei, nitrate (I\I03~), sulfate (S04=), tem-
perature and dew point. The ground sta-
tion  measured  these and a number of
other variables.

Results and Conclusions
  Important findings of the study can be
summarized as follows.
  •  The weather during the Boston plume
     study was generally rainy and over-
     cast, interspersed with a few sunny
     clear days.  Pollutant levels  at  the
     ground station in Beverly were usu-
     ally low. On a few days, southwesterly
     winds transported Boston's polluted
     air to Beverly. One very clear case of
     pollutant transport occurred on Au-
     gust  16, when 03, PAN, and light-
     scattering aerosol reached very high
     levels just before dawn.
  •  Table 1 gives the 24-h distribution
     of oxidized nitrogen for a  subset of
     14 days during which all  the perti-
     nent  species  were measured.  The
     usual  oxidized-nitrogen burden at
     Beverly Airport was low because of
     its location (the emissions density to
     the west, north, and east was quite
     low).  On average, about 14% of the
     oxidized nitrogen was present in the
     form  of reaction products. The ratio
     of the  average PAN  and HON02
     concentrations was 1.8.
  •  The concentration of nitrate in the
     aerosol phase was extremely low at
     Beverly Airport, with gaseous nitrates
     accounting  for 98%  of  the  total
     atmospheric nitrate. For comparison,
     gaseous nitrate as a proportion of
     total nitrate for several geographical
     locations is given in Table 2.  For
     many of the locations, gaseous ni-
     trate dominated the total nitrate bur-
     den, as observed at Beverly.
  •  Based on  four days of flights for
     which detailed analysis is presented,
     the removal of NOX from the trans-
     ported Boston plume followed first-
     order kinetics reasonably  well.  The
     pseudo-first-order rate constant for
     NOX removal ranged from 0.14 h"1 to
     0.24 rr1 with a mean of 0.18  hr"1.
     Maximum 03 concentrations in the
     plume on  these four days  ranged
     from  0.095 to 0.160 ppm.
  •  On the days when all the necessary
     data  were available, the nitrogen
     balance in the plume was accounted
     for with PAN and HON02 account-
     ing for nearly all the reacted NOX. For
     example, during three transects of
     the  urban plume on August  30,
     1978,  the  nitrogen  mass balance
     averaged 88%.
  The pseudo-first-order rate  constants
obtained in these experiments  provide a
basis for estimating the lifetime of NOX (as
NO + N02) in transported urban air under
photochemically active  conditions.  The
lifetime, r, can  be  defined as the  time
required for chemical and physical removal
 Table 1.    24-Hour Distribution of Oxidized Nitrogen


                         Concentration (ppm)
           Fraction of Total Oxidized
                Nitrogen (%J
NOX (NO + NO2)
PAN
HON02
N03-
0.018
0.0018
0.0010
0.00004
86
9
5
1

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Table 2
Gaseous Nitrate Measured at
Several Locations
Gaseous Nitrate
Location Total Nitrate
St. Louis. MO (197 3)
WestCovma, CA(1973]
Phoenix, AZ (1977)
Temple City, CA (1976)
Up/and, CA(1976)
Rubidoux, CA (1976)
Beverly, MA (1978)
95
98
50
75
.96
.45
.98
processes to reduce the NOX concentra-
tion to 1/e  of its initial value (i.e. when
(NOJp=

(N0x)t
Substituting into the integrated form of
the rate equation,

  .  (NOx)o   ,
  1 n - = kt
     (N0x)t

  1 n e = kr
  For the four available  experiments, r
ranges from 7.1 to 4. 2 hr. The average of
the four rate constants yields a lifetime of
5.5 h. The  NOX half-life defined as
      0.69
                                 Chester W. Spicer, John R. Koetz, G. William Keigley, George M. Sverdrop, and
                                   Gerald F. Ward are with Battelle-Columbus Laboratories, Columbus, OH 43201,
                                 William A. Lonneman is the EPA Project Officer (see below).
                                 The complete report, entitled "Nitrogen Oxides Reactions  Within Urban Plumes
                                   Transported Over the Ocean," (Order No. PB 83-196 378; Cost: $17.50, subject
                                   to change) will be available only from:
                                         National Technical Information Service
                                         5285 Port Royal Road
                                         Springfield, VA  22161
                                         Telephone: 703-487-4650
                                 The EPA Project Officer can be contacted at:
                                         Environmental Sciences Research Laboratory
                                         U. S. Environmental Protection Agency
                                         Research Triangle Park, NC 27711
                                                                               *US GOVERNMENT POINTING OFFICE 1983-659-017/7169
averages 4.1  h.
  To the best of our knowledge, this is the
first determination of NOX lifetime in pol-
luted  urban air. The reported values are
applicable only to daylight  hours under
sunny, photochemically active conditions.
Further research will be required before
these  conclusions can  be  extended to
other areas with different meteorological
conditions or emissions factors.

References
1.   Breeding, R. J., Klonix,  H. B., Lodge,
    J P., Jr., Pate, J. B., Sheesley, D. C.,
    Englert, T. R. and Sears, D. R., Atmos
    Environ  10, 181  (1976).

2.   Spicer, C. W., "The Fate of Nitrogen
    Oxides   in   the   Atmosphere",  in
    Advances   in  Environmental
    Sciences, V 7, Pitts, J. N. and Metcalf,
    R  L, eds., John  Wiley, New York,
    New York, (1977).

3   Calvert, J. G , Environ  Sci. Technol.
    10, 256 (1976).

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Information
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