United States
                    Environmental Protection
                    Agency
Environmental Sciences
Research Laboratory
Research Triangle Park NC 27711
                    Research and Development
EPA-600/S7-83-059  Jan. 1984
&ER&          Project  Summary
                    The  ENAMAP-2  Air  Pollution
                    Model for  Long-Range Transport
                    of  Sulfur  and  Nitrogen
                    Compounds

                    R. M. Endlich, K. C. Nitz, R. Brodzinsky, and C. M. Bhumralkar
                     This  report  describes the Eastern
                    North American Model for Air Pollution
                    (ENAMAP-2),  which simulates long-
                    range  air pollution transport over
                    eastern North America. The ENAMAP-
                    2S version  of the model uses SOx
                    emissions  data inventories and
                    standard  daily weather reports  to
                    compute the airborne concentrations of
                    SO2 and sulfate and their deposition on
                    the  earth's   surface.   ENAMAP-2S
                    operates  in  a  Lagrangian manner by
                    tracking pollution puffs emitted period-
                    ically over the grid domain. As each puff
                    travels  with  the  winds,  chemical
                    processes occur, and the puff loses
                    pollutant  mass through dry and wet
                    deposition processes. For each grid cell,
                    the deposition amounts and airborne
                    pollution  concentrations  are
                    summarized for periods generally taken
                    as one month.
                     The  newest form  of the  model
                    includes the  influences of smoothed
                    terrain  on the winds and divides the
                    atmospheric boundary layer into three
                    parts, allowing pollution emissions to
                    be  partitioned among the  layers.
                    Vertical  mixing  is controlled  by
                    diffusion  coefficients computed from
                    fields of  wind shear,  stability, and
                    mixing  depth.  The transformation and
                    wet and dry deposition rates are based
                    on recent information. However, there
                    are still substantial uncertainties about
                    them.

                     This Project Summary was developed
                    by  EPA's Environmental  Sciences
                    Research Laboratory, Research Triangle
Park, NC, to announce key findings of
the research project  that is fully
documented in a separate report of the
same title (see Project Report ordering
information at back).

Introduction
  SRI International (SRI) has developed a
numerical  model  for calculating  the
ambient concentrations and depositions
of pollutants. This research was
sponsored  by Umweltbundesamt of the
Federal Republic of Germany  for
application in Europe  and by the U.S.
Environmental Protection Agency for
application in North America. During the
two phases of model development, SRI
has replaced the simplistic parameter-
izations in the North American version
(ENAMAP-1) with more complex param-
eterizations expressed in terms of known
or theoretical physical relationships.
  The final version of the North  Ameri-
can  model (ENAMAP-2) includes
transformation rates dependent on solar
insolation, dry deposition  rates
dependent on surface characteristics,
stability, and time of day,  and  wet
deposition  rates dependent on rain type.
In addition, ENAMAP-2 divides  the
planetary  boundary  layer into three
layers. This version of the model accounts
for diurnally changing mixing depths and
the vertical mixing of pollutants based on
vertical mixing coefficients expressed in
terms of atmospheric stability.
  The ENAMAP-2S  model,  which
pertains to  sulfur  compounds, was
applied  to  simulate  wet  and  dry
depositions and  monthly  average

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ambient  concentrations  of S02  and
sulfate  for January and  August
1977. These model results were com-
pared to those generated  earlier by
the more simplistic one-layer version. In
addition,  a  model sensitivity study  was
conducted. The ENAMAP-2N version was
applied   to   simulate  wet  and  dry
depositions  and average  ambient con-
concentrations of NO, NO2, NOi, HN03,
and PAN.

ENAMAP-2S Applications
  The sulfur budgets of the emissions
from Ohio,  Indiana,  and  Illinois were
computed from the January and August
1977   ENAMAP-2S  and   ENAMAP-1
applications  to  assess the  resultant
effects of the model modifications.  The
January and August sulfur budgets are
presented in Tables 1 and 2, respectively.
The two models did not differ significantly
for the   ambient  S02   or   sulfate
concentrations.  However,   the  budget
comparisons showed a  significant
                              increase of dry sulfate deposition  for
                              ENAM AP-2S. This was due to the replace-
                              ment of the low nocturnal dry deposition
                              rates with the higher rates used for the
                              daytime. On the other hand, the sulfate
                              wet  deposition showed a decrease  for
                              ENAMAP-2S. Total deposition of sulfate
                              computed by ENAMAP-2S was approxi-
                              mately 90% greater than that calculated
                              by its predecessor for January and only
                              8% greater for August.
                                After ENAMAP-2S was applied for the
                              entire  model  domain  using emissions
                              from all states and provinces within the
                              domain for January and August 1977, the
                              monthly average S02 and sulfate concen-
                              trations and SO2 wet and dry depositions
                              did  not differ significantly from those
                              computed  from   ENAMAP-1.  The
                              significant differences in the sulfate wet
                              and  dry depositions resulted from the
                              higher nocturnal sulfate  dry deposition
                              rates used in ENAMAP-2S.
                                The effects of the greater complexities
                              in ENAMAP-2S seemed to have  been
Table 1.
Comparison of ENAMAP-1 and ENAMAP-2S Budgets for Illinois. Indiana, and Ohio
Emissions (kton) for January 1977
           Process
                                                      ENAMAP-1   ENAMAP-2S
SO2
  Total emitted
  Wet deposition
  Dry deposition
  Flux*
  Transformation fSO2 -~
SO;
  Emitted
  Total emitted and transformed
  Wet deposition
  Dry deposition
  Flux*
                                                 645.1
                                                  -7.2
                                                -213.5
                                                -165.4
                                                -259.0
                                                  15.3
                                                 403.8
                                                 -11.7
                                                -131.7
                                                -260.4
645.1
  -7.5
-242.6
-126.7
-268.4
  15.3
 417.9
  -8.6
-262.6
-146.7
 "Flux is the amount of SOa or SO< that was transported out of the model domain by the wind.
 Table 2.
 Comparison of ENAMAP-1 and ENAMAP-2S Budgets for Illinois. Indiana, and Ohio
 Emissions (kton) for August 1977
           Process
                                                      ENAMAP-1   ENAMAP-2S
 S02
   Total emitted
   Wet deposition
   Dry deposition
   Flux*
   Transformation (SOz — SOI )
  Emitted
  Total emitted and transformed
  Wet deposition
  Dry deposition
  Flux*
                                                 582.9
                                                 -164.7
                                                  -68.1
                                                   -7.5
                                                 -342.3
                                                   12.4
                                                 525.9
                                                 -305.7
                                                 -170.7
                                                  -49.5
 582.9
-153.9
 -88.7
  -1.7
-338.5
  12.4
 520.3
-238.4
-273.4
   -8.5
 "Flux is the amount of SOi or SOI that was transported out of the model domain by the wind.

                                   2
smoothed over the  month  simulation
period. One could  have expected the
three-layer  model  to  compute  lower
ambient concentrations in Layer 1, close
to the surface, since this version of the
model considers  nocturnal  mixing
heights. However, due to the exaggerated
nocturnal mixing  heights used in these
applications,  pollutants from  Layer  2
were mixed to the surface throughout the
night.

ENAMAP-2S Sensitivity Tests
  In order to minimize the costs of sensi-
tivity testing, ambient concentrations and
depositions were  calculated  across the
entire  model  grid   using  only  the
emissions from Ohio (which was near the
center of the grid) for August 1977. The
baseline or nominal case used the model
input   parameter  values  applied  in
previous  model runs.  The  parameters
that were adjusted during this sensitivity
analysis included:

  1) transformation  rate

  2) SOz and sulfate wet and dry deposi-
     tion rates

  3) proportion  of nocturnal emissions
     injected into Layer 1, and

  4) vertical diffusion coefficients.

  When   compared   to  air  quality
measurements, the ENAMAP-2S
ambient sulfate concentrations appeared
to be significantly higher. On the other
hand, the SO2 concentrations showed no
consistent  bias.  The  results  of the
sensitivity  analysis  indicated  that  a
combination of 1) reducing  the  homo-
geneous  transformation  rate  by 25%,
2) increasing the wet and dry depositions
by 25%, and 3) partitioning the nocturnal
pollution injections  25% in Layer 1 and
75% in Layer 2  yielded results which
compared well with  measurements.

ENAMAP-2N  Description  and
Applications
  A major portion of this phase of the
project was devoted to the adaptation of
the sulfur version  of  ENAMAP-2  to a
version designed to  simulate, in a linear
fashion,  the depositions and  complex
non-linear chemical transformations  of
nitrogen  compounds.  In ENAMAP-2N,
the primary gaseous pollutants, NO and
NO2, form an initial puff over each emitter
cell. The concentrations of the two are
calculated and equilibrated with a  diur-
nally varying equilibrium constant. The

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NOa can react to form PAN, HN03, and
NOa, with the products formed in a 5:4:1
molar  ratio. The reaction rate of NO2
varies dirunally.
  The dry and wet deposition rates of the
nitrogen  compounds  are  defined
according to Tables 3 and 4, respectively.
Wet deposition  rates  for the nitrogen
compounds are expressed as fractions of
those for the sulfur compounds used in
ENAMAP-2S.
  Concentration and wet and dry deposi-
tion patterns and source/receptor rela-
tionships for the months of January and
August 1977 for all five nitrogen com-
pounds  were determined during this
project.  In general,  these  simulated
patterns seem quite reasonable in terms
of what  one would expect for regionally
averaged concentrations. Unfortunately,
no  air  quality measurements existed for
1977 to  evaluate the model.

Table 3.   Dry Deposition Velocities
          for Atmospheric Nitrogen
          Compounds
Compound
NO?, NO
HNO3
PAN
/VOa~ (aerosol)
Va (cm s"V
Day Night
0.2
10
0.25
0.6
0.07
007
0.07
0.6
Table 4.   Wet Deposition Hates for
          Atmospheric Nitrogen Compounds
          Expressed as Fraction of Rates
          fa) for SOX
Compound
NO2. NO
HN03
PAN
NO3~ (aerosol)
Relative Rate
0.25 x ctSOz
0.50 x ctHzSO*
0.50 x ctSOz
ocHiSOz
been responsible for the fact that these
differences were  insignificant. The dry
deposition of sulfate did vary significantly,
because  the nocturnal  dry deposition
rates  were  significantly  increased  in
ENAMAP-2S applications.
  The sensitivity testing of ENAMAP-2
indicated  that the resultant  effect  of
reducing  the  transformation  rate,
increasing the wet and dry deposition
rates, and  apportioning  some of the
nocturnal emissions into Layer 1 yielded
results that compared well with measure-
ments. Further model  evaluations using
these new values and  several months of
meteorological data are required before
solid conclusions can be drawn.
   R.  M. Endlich K. C. Nilz, R. Brodzinsky,  and C. M.  Bhumralkar are with SRI
     International, Menlo Park, CA 94025
   Terry L. Clark is the EPA Project Officer (see below).
   The complete report, entitled  "The ENAMAP-2 Air Pollution Model for Long-
     Range Transport of Sulfur and Nitrogen Compounds," (Order No. PB 84-120
     930; Cost: $22.50, 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 PRINTING OFFICE 1984-759-015/7280
Conclusions
  The  ENAMAP-2S  ambient  S02
concentrations compared favorably with
measurements,  but the calculated
ambient  sulfate  concentrations  were
significantly  greater.  The  ENAMAP-
2S/ENAMAP-1   comparisons  showed
that  the concentration  fields differed
insignificantly,  thus  the  testing  of
ENAMAP-2 indicated that  the resultant
effects of the more complicated parame-
terizations  of  ENAMAP-2S  were
smoothed over the  month  simulation
periods.  However,   the  exaggerated
nocturnal  mixing  heights  used in the
ENAMAP-2S  applications  could  have

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