United States
Environmental Protection
Agency
                                                    Atmospheric Sciences
                                                    Research Laboratory
                                                    Research Triangle Park NC 27711
">»
Research and Development
                                                    EPA/600/S3-88/025 Sept. 1988
&EPA         Project  Summary
                   Improved  Parameterizations  for
                   Surface  Resistance  to  Gaseous
                   Dry  Deposition  in  Regional-
                   Scale,  Numerical  Models
                   M. L. Wesely
                     Methods for estimating the dry deposi-
                   tion velocities of atmospheric gases in
                   the United States and surrounding areas
                   have been improved. The improvements
                   have been incorporated into a revised
                   module of computer coding for use in
                   numerical  models of atmospheric
                   transport and deposition of pollutants
                   over regional scales. As before, the dry
                   deposition module computes deposition
                   velocities for five seasonal categories
                   and 11 landuse types specified in a land-
                   use map. The key improvement is the
                   computation of bulk surface resistances
                   according to three distinct pathways of
                   mass transfer: to the upper portions of
                   vegetative canopies, to the lower por-
                   tions of canopies or structures, and to
                   the ground (or water surface). This ap-
                   proach replaces the previous technique
                   of providing simple tables for looking up
                   bulk surface resistances. With the sur-
                   face resistances  divided explicitly into
                   several  pathways,  the bulk surface
                   resistances for a large number of gases
                   can be computed in addition to those for
                   gases  considered  in the previous
                   module (SO2, 03, NOX, and HNO3), if
                   estimates of the  effective Henry's Law
                   constants and appropriate measures of
                   the chemical reactivity of  the various
                   substances  are known. This has been
                   accomplished successfully for H2O2,
                   HCHO, acetaldehyde (to represent other
                   aldehydes),  methyl hydroperoxide (to
                   represent organic peroxides),  peroxy-
                   acetic  acid,  HCOOH  (to represent
                   organic acids), NH3, PAN,  and  HN02.
                   Other factors considered include surface
                   temperature, stomatal response to en-
                                 vironmental parameters, the wetting of
                                 surfaces by dew and rain, and the cover-
                                 ing of surfaces by snow. Surface emis-
                                 sion of gases and variations of uptake
                                 characteristics  by individual plant
                                 species within the landuse types are not
                                 considered explicitly.
                                   This Project Summary was developed
                                 by EPA's Atmospheric 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 Pro-
                                 ject Report  ordering  information  at
                                 back).

                                 Introduction

                                   Dry deposition  of gases from the at-
                                 mosphere provides a primary means of
                                 cleansing the atmosphere and delivering
                                 chemical doses to surface components.
                                 Numerical simulation of dry deposition is
                                 important in evaluating the relationships
                                 between emissions in one area and deposi-
                                 tion in another. The dry deposition module
                                 of the Regional Acid Deposition Module
                                 (RADM) has been used to compute the dry
                                 deposition  velocities for SO2, O3, NOX
                                 (defined as the sum of NO  and NO2),
                                 sulfate (in submicron particles), and HNO3
                                 in the United States and southern Canada.
                                 The basis for the parameterizations of the
                                 deposition  velocities  were  micro-
                                 meteorological formulas and, for SO2, O3,
                                 and NOX, tables of resistances to uptake.
                                 The purpose of the present work is to put
                                 these tables on a more solid scientific
                                 footing, within a framework that enables
                                 logical  extension  to additional gaseous

-------
substances such as H202, HCHO, other
aldehydes, organic peroxides, peroxyacetic
acid, organic acids, PAN, NH3, and HNO2.
Other improvements include a more explicit
means to evaluate changes in surface
resistances caused by the effects of surface
wetness associated with dew and rain.

Procedures
  The general approach commonly used
in resistance models of dry deposition of
gases is summarized by the  following
formula:
             = (ra + rb + rc)~
(D
where va is the deposition velocity, which
can be multiplied by the concentration at
a specific height to produce the deposition
rate; r& and rb are gas-phase resistances
to vertical transport, which are computed
by conventional means; and rc is the bulk
surface resistance and is the focus of this
work. In the previous version of the dry
deposition module, the estimates of rc for
SO2 and O3 were obtained  from simple
tables for looking up surface resistances for
each of the 11 landuse types specified in
a computerized landuse map (urban land,
agricultural land,  range  land, deciduous
forest, coniferous forest, mixed  forest in-
cluding wetland, water, barren land,  non-
forested wetland, mixed agricultural and
range land, and rocky open areas occupied
by low-growing shrubs). The tables were
duplicated for each  of five  seasonal
categories (midsummer,  autumn,  late
autumn, winter with snow, and transitional
spring). The  values of rc for NOX were
calculated with a simple function of the
values for O3, and values of rc for HNO3
were assumed to be very small in all cases.
  The improved procedures for the revised
module divide the bulk surface resistance
into component resistances for three ma-
jor pathways of mass flux, as is shown in
Figure 1. To implement this model, a table
of numerical values of the component
resistances (except for rm) is provided for
the landuse types and seasonal categories
specified  above.  The   component
resistances are as follows:

  (i) rs, the leaf  stomatal resistance for
    water vapor (the table lists minimum
    values, and an algorithm is supplied
    to compute rs as a function of solar ir-
    radiation  and surface temparature);
 (ii) rm, plant  mesophyll resistance (com-
    puted entirely from algorithms);
(iii) nu, resistance at the outer surfaces of
    leaves in the upper canopy;
(iv) rdc, a gas-phase dynamic resistance
    from the top of the canopy to the SUr-
                    fa, aerodynamic


                    /V sublayer
                                   Vegetation
                    r
-------
  Consistent with experimental observa-
tions, the resistances for NO2 for surfaces
other than sunlit vegetation appear to be
quite large,  a result of the relatively low
solubility and chemical reactivity of NO2.
The resistances for NO indicate practical-
ly no surface uptake.  It is recommended
that the sum of NO and NO2 should be con-
sidered, not either alone, because rapid in-
air chemical reactions can change the ver-
tical fluxes of each of these substances but
do not change the sum of the two fluxes.
Another factor that should be considered
for these nitrogen oxides, as well as NH3,
is that surface emissions due to biological
activity can obviate  the usefulness of the
air-surface exchange rates estimated with
the  present  scheme.  More  realistic
estimates would be produced if an internal
concentration corresponding to a compen-
sation point, typically  a  few ppbV, were
asumed for Cm, C|U, Cci, or Cg in Figure 1,
rather than the value of zero implied when
deposition velocities are used with air con-
centrations to estimate fluxes.
  The resistances  computed  for other
substances  are predictions that usually
have few, if any, supporting  field data.
Hydrogen peroxide has the unusual proper-
ties of being both moderately soluble in
water and a strong oxidizing agent. Rapid
removal takes place at wet surfaces, and
moderately  rapid deposition occurs over
vegetation. Many surfaces that may seem
somewhat  inert,  such as   those  in
unharvested agricultural  areas, remove
H202 fairly  efficiently.  Solubility alone is
highlighted  in the  surface resistances
calculated for formaldehyde (HCHO), for-
mic acid (HCOOH, or ORA to represent
organic acids), and acetaldehyde (CH3CHO,
or ALD to represent aldehydes other than
HCHO). Formaldehyde is taken up rather
rapidly at liquid water surfaces and by sunlit
vegetation, but has much less interaction
with soils and senescent vegetation. The
rather large solubility of formic acid allows
it to be taken up rapidly at many different
types of surfaces. Variations on the same
theme are seen for NH2  and HNO2.

  The remaining three substances, methyl
hydroperoxide (CH3O2H, or OP to represent
several organic  peroxides),  peroxyacetic
acid [CH3C (0) O2H, or PAA], and peroxy-
acetyl nitrate [CH3  (O) O2NO2, or PAN],
have slightly  limited  solubility  and  are
moderately reactive as oxidants. PAN is the
least soluble and thus has the largest sur-
face resistance of the three substances for
sunlit green vegetation, although the low
solubility of PAN is offset  somewhat by its
relatively higher reactivity. This behavior of
PAN  is  consistent  with  laboratory
observations.
  In conclusion, the dry deposition module,
which is available along with the landuse
map in computer-compatible form, provides
a means to estimate the  dry deposition
velocities for many substances. Limitations
include the fact that the module categorizes
all surfaces by only  11 landuse types and
considers  only five general  seasonal
categories. Estimates  of  dry deposition
velocities are probably not very accurate for
short  periods of time or for a  particular
small area. Rather,  the estimates are in-
tended for long-term averages over at least
several  weeks and for rather large areas,
over which the individual variations of plant
species composition and factors such as
soil moisture content are  smoothed. For
vegetation, uptake resistances by individual
plant species have not been identified, and
the influence of varying amounts of leaf
area (green or senescent) has not been tied
explicitly to a measurable quantity such as
LAI (leaf area index). The following factors
are  considered  in  a  general fashion:
vegetation height, aridity or soil moisture
content, surface temperature, and varia-
tions of leaf stomatal resistance with solar
radiation and temperature. A number of fac-
tors that can strongly influence air-surface
exchange are not considered.  These in-
clude the differences between  sea water
and fresh water, the effects of fog or impac-
ting cloud water at high  elevations, soil
alkalinity  or acidity, and  natural surface
emissions.
    M. L Wesely is with Argonne National Laboratory, Argonne, IL 60439..
    James M. Godowitch is the EPA Project Officer (see below).
    The complete  report, entitled "Improved Parameterizations for Surface Resistance
      to Gaseous  Dry Deposition in Regional-Scale, Numerical Models," (Order No. PB
      88-225 099/AS; Cost: $ 14.95, 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:
            Atmospheric Sciences Research Laboratory
            U.S. Environmental Protection Agency
            Research Triangle Park, NC 27711

-------
United States
Environmental Protection
Agency
                                                                                                                   •VJv*
Center for Environmental Research
Information
Cincinnati OH 45268
    u 3 OFfIP^Ml^-I
"^^-TYi  JlPOST/tfE i-
Official Business
Penalty for Private Use $300

EPA/600/S3-88/025
              0000 3Z 9    PS
                                        IL

-------