United States
                  Environmental Protection
                  Agency
National Exposure
Research Laboratory
Las Vegas, NV 89193-3478
                  Research and Development
EPA/600/S-97/004
July 1997
&EPA      Summary  Report

                  Determination of  Pollutant
                  Distribution  and  Movement  by
                  Controlled  Laboratory
                  Experiments

                  David K. Kreamer, David E. James and Katrina E. Varner
                   The goal of this project was to di-
                  rectly observe and evaluate the sub-
                  surface movement and distribution of
                  selected volatile organic compounds,
                  particularly components of petroleum
                  fuels, through controlled laboratory ex-
                  periments. Sand  tank, column,  and
                  batch-type laboratory experiments were
                  employed to measure the effect of spe-
                  cific variables associated with under-
                  ground contamination events. The sand
                  tank experiments  were carried out to
                  characterize leak sources and contami-
                  nant movement. Leak rate, petroleum
                  type, soil type, temperature, and back-
                  fill configuration were examined to de-
                  termine which materials and methods
                  produced results that had the best ap-
                  plication to field and regulatory situa-
                  tions. The spatial and temporal propa-
                  gation of leaking fluids was measured
                  and recorded by several methods in-
                  cluding gas chromatography and time-
                  lapse photography. The spatial and tem-
                  poral measurements of vapor concen-
                  trations were mathematically modeled
                  using two-dimensional inverse meth-
                  ods. Diffusion parameters of Effective
                  Diffusion Coefficient, De, and Sorption-
                  corrected Porosity, A*,  were  deter-
                  mined, with De for gasoline generally
                  ranging from approximately 0.0024 cm2/
                  sec for  clay to 4.4 cnWsec for pea
                  gravel. Calculated diffusion parameters
                  were used to predict three-dimensional
                  propagation of vapors, and results were
                  compared with field and laboratory val-
                  ues. Additionally, the sand tanks were
                  used to measure the distribution of light
                  non-aqueous phase liquids around the
                  water table during conditions of verti-
cal water table movement. Some of the
results from the research indicate that
the distribution  of hydrocarbons in
these situations is more extreme than
previously recognized,  and  that en-
trapped diesel fuel in sands ranged
from 33 to  67 liters/cubic meter. Di-
mensional analysis as well as color-
density dye  studies  were  also per-
formed on the physical modeling.
  In  other  work,  plastic  columns
equipped with fiber optic sensors were
used to measure diffusion parameters
from gasoline and diesel sources. One-
dimensional  mathematical  modeling
was applied to observed concentration
values to calculate diffusion param-
eters. The data were compared with
the findings of other researchers, and
the reproducibility of results was evalu-
ated. Generally, experimental reproduc-
ibility was quite good, and the fiber
optic probes showed  a large dynamic
range to maximum responses of 22,000
to 35,000 ppmv for gasoline and 43,000
to 62,000 ppmv for diesel fuel.  Field
operation of fiber optic devices was
also evaluated.
  Sorption studies of  selected organic
compounds on various soils were car-
ried out in enclosed  steel chambers.
The chambers allowed measurement of
sorption in  soil  media configured to
simulate actual field  conditions. Soil
moisture content,  temperature, soil
type, vapor pressure,  and soil organic
content were incrementally  varied.
Moisture content of an unsaturated soil
was generally the most important vari-
able affecting sorption in vadose zone
materials. Partitioning coefficients were

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found  to  be relatively  independent of
the degree of saturation  when  gravi-
metric water contents exceeded 2-5%.
These findings correlate well with sorp-
tion-corrected porosity values obtained
from inverse mathematical modeling of
physical sand  tank and column mod-
els. While some compounds displayed
sorption fitting a Freundlich isotherm,
dry soils  typically  exhibited nonlinear
isotherms  and finite sorption kinetics.
Hydrogen-bonding compounds also
displayed  nonlinear isotherms  and fi-
nite sorption and  desorption  kinetics
in the  presence of water. A recalcitrant
fraction was observed  to  be resistant
to desportion, especially  with  certain
compounds in  clays.

Goals and Objectives  of the
Research
  The  goal of this project was to directly
observe  and  evaluate  the subsurface
movement  and distribution  of selected
volatile  organic compounds,  particularly
components of petroleum fuels, through
controlled  laboratory experiments. Sand
tank, column, and  batch-type laboratory
experiments were used  to  measure the
effect of specific variables associated with
underground contamination events. Many
of the  studies centered  on  gaseous mi-
gration, and the variables examined in-
cluded moisture content, soil type/grain
size, leak rate, temperature,  and vapor
densities.
  Objectives  included: 1) establishing a
visual record through time-lapse photog-
raphy of the movement of organic liquids
through unsaturated porous media, 2) aug-
mentation  of this visual record with quan-
titative measurements of vapor concen-
tration  and migration, 3) observation of
effect of the water table on the distribution
of non-aqueous phase liquids, and 4) the
quantitation of sorptive partitioning of the
gaseous phase organics onto and  into
porous material and  water. This work pro-
vided a video which  has been extensively
used for educational purposes, publica-
tions in refereed journals, publications in
conference proceedings,  and several
master's theses.

Research Approach
  There were three components  of the
research approach: sand tank experiments,
column experiments, and batch-type sorp-
tion experiments. As the work progressed,
the research approach underwent review,
at times partial revision, and augmenta-
tion to  optimize  results.
  Sand tank experiments were carried out
to characterize leak sources and contami-
nant movement. Experiments were first
performed to vary the tank filling  proce-
dure to allow the best reproducibility pos-
sible in  the experimentation.  Leak rate,
petroleum type, soil type, temperature, and
backfill configuration were  examined  to
determine which materials and  methods
produced results that had the best appli-
cation to field and regulatory situations. In
another aspect of experimentation, it was
quickly discovered that the sand tank  en-
vironment was inadequate to simulate  va-
por extraction  remediation;  gaseous  ad-
vection on the small sand tank scale suf-
fered boundary interferences which were
too severe  to proceed using the smaller
volume tanks proposed in this work.
  In vadose zone  leak  simulations per-
formed in the sand tanks, liquid and vapor
measurements were made.  The  spatial
and temporal propagation of leaking fluids
was measured and  recorded  by several
methods  including  gas  chromatography
and time lapse photography. Contour maps
of the distribution of leaked fluids were
constructed.  The spatial  and temporal
measurements  of vapor concentrations
were mathematically  modeled using two-
dimensional inverse  methods. Diffusion
parameters of Effective  Diffusion  Coeffi-
cient, De,  and Sorption-corrected Porosity,
A*,  were  determined. Calculated diffusion
parameters were used  to predict three-
dimensional propagation of vapors, and
results were compared with field and labo-
ratory values. Additionally, the sand tanks
were used to measure the distribution of
light non-aqueous phase liquids around
the water table during conditions of verti-
cal water table movement.
  Column experiments took  on  several
forms.  Experiments  were performed  to
measure  the  flux of  organic compounds
across the  water table.  A glass  column
equipped with side ports was used to  de-
termine the feasibility of this approach.
Additionally, plastic columns equipped with
fiber optic sensors were used to measure
diffusion  parameters from gasoline and
diesel sources.  One-dimensional math-
ematical modeling was applied to observed
concentration values to calculate diffusion
parameters. The data were compared with
the findings of other researchers.  The re-
producibility of results was evaluated.
  Sorption  studies  of  selected  organic
compounds on various soils were carried
out. Experiments in enclosed steel cham-
bers were conducted. The chambers al-
lowed measurement of  sorption  in soil
media configured to simulate  actual field
conditions. Soil moisture content, tempera-
ture, soil type, vapor pressure,  and soil
organic  content could be controlled and
incrementally varied.

Summation of Individual Areas
of Research

Sand Tank Experiments
  Through  controlled  laboratory experi-
ments, the effect of specific variables as-
sociated with underground contamination
events was examined with time-lapse pho-
tography and quantitative measurements
of vapor concentration and migration. The
research approach had several  subcom-
ponent activities. Initial sand tank experi-
ments examined the tank filling procedure
with the objective to allow the best repro-
ducibility possible  in the experimentation.
Although several procedures were  used,
the most reproducible  filling  technique in-
volved the gravity  release of soil into a
tank through a overhead funnel equipped
with sieves.  This methodology is visually
shown in  a  short  video  (available  from
authors), and is described in James et al.
(1996a).
  Another subcomponent of the sand tank
activities involved the measurement of liq-
uid and  gaseous propagation from  a pe-
troleum hydrocarbon leak. The goal of this
endeavor was to characterize leak propa-
gation, hopefully in a way  amenable to
mathematical modeling. This undertaking
was successful. The spatial  and  temporal
propagation  of  leaking fluids was  mea-
sured and recorded by the  methods dis-
cussed previously.  Contour maps (in re-
gards to the distribution of leaked fluids)
were constructed. Time-lapse movement
of liquid migration  is shown  in the  video
tape. The spatial and  temporal measure-
ments of vapor concentrations were  math-
ematically modeled to determine values
of coefficients and porosity.  For example,
De for gasoline was  generally  found  to
range from approximately 0.0024 cm2/sec
for clay to 4.4 cm2/sec for pea gravel.
Calculated diffusion parameters were used
to predict three-dimensional propagation
of vapors, and results were compared with
field and laboratory values.  Mathematical
modeling of gaseous movement  is  de-
tailed  in  Chaganti  (1990), Johnson and
Kreamer (1994), Kreamer et al. (1996),
and Squire  (1996). Calculated  gaseous
diffusion parameters showed conformance
to the few values available in the  litera-
ture.  Optimal leak rates, petroleum types,
soil types, temperatures, and backfill con-
figuration  were examined to determine
those procedures  allowing  efficient and
safe  experimental  techniques, while re-
taining applicability to  real field and regu-
latory situations.

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  In another aspect of  experimentation,
the  sand tanks were used to measure the
distribution of light non-aqueous phase liq-
uids (LNAPLs) around the water table dur-
ing  conditions of vertical water table move-
ment. This aspect of research is shown  in
the  video, and is reported in James et al.
(1996a, 1996b), Rajagopalan (1995), and
Sabapathi (1993). Results indicated that
the  distribution of hydrocarbons in these
situations is more excessive than previ-
ously recognized,  and that entrapped die-
sel  fuel in  sands ranged from 33 to 67
liters/cubic  meter.  Dimensional analysis
and color-density dye studies were  also
performed on the physical modeling.

Column Studies
  Column  studies were undertaken  to
measure the flux of organic compounds
across the water table and capillary fringe,
and to determine diffusion parameters from
gasoline and diesel sources. A glass col-
umn equipped with side ports was used  to
determine the feasibility  of vertical flux
measurements. This line of experimenta-
tion was basically unsuccessful. Slow dif-
fusion in the  aqueous  phase (approxi-
mately 5 orders of magnitude slower than
gaseous diffusion),  coupled with advec-
tion created by withdrawal of water and
vapor during sampling, created results with
little reproducibility.  Spacing  of the  side
ports was also too wide, and the perturba-
tion of the soil column created by syringe
sample withdrawal appeared to be largely
responsible  for the  lack  of reproducible
results.  To  gain  some understanding  of
hydrocarbon  movement  and distribution
near the water table,  studies of vertical
LNAPL distribution around moving water
tables were  initiated in sand tanks as de-
scribed earlier (James etal., 1996a, 1996b;
Rajagopalan, 1995; Sabapathi,  1993).
  Additionally, plastic  columns equipped
with fiber optic sensors were used  to mea-
sure diffusion  parameters from gasoline
and diesel sources (Kreamer et al., 1996).
One-dimensional  mathematical modeling
was applied  to  observed concentration
values to calculate diffusion  parameters.
The data were compared with the  findings
of other researchers and the reproducibil-
ity  of results was evaluated. Generally,
experimental  reproducibility was  quite
good, and the fiber optic probes showed a
large  dynamic range to  maximum re-
sponses of  22,000  to 35,000  ppmv for
gasoline and 43,000 to 62,000 ppmv for
diesel fuel.  Field  operation of fiber optic
devices was also evaluated (Kreamer  et
al.,  1996).
Sorption Batch  Testing
  Sorption studies  of selected  organic
compounds on various soils were carried
out in enclosed steel  chambers (Fairley,
1993; Houston  and  Kreamer, 1989; Oja
and Kreamer, 1992;  Kreamer et al., 1994;
Schmeltzer, 1993; Steinberg  et al., 1994;
Steinberg and Kreamer, 1992, 1993). The
chambers  allowed measurement of sorp-
tion in  soil media configured to simulate
actual field conditions. Soil moisture  con-
tent, temperature, soil type,  vapor pres-
sure, and  soil organic content could be
controlled  and incrementally varied.
  Moisture content of an unsaturated soil
was generally the most important variable
affecting sorption in  vadose zone materi-
als. Partitioning  coefficients were found to
be relatively independent of the degree of
saturation  when gravimetric water content
exceeded  2 to 5%. These  findings corre-
late well with sorption-corrected porosity
values  obtained from inverse mathemati-
cal  modeling  of physical  sand tank and
column models. While some compounds
displayed sorption fitting a Freundlich iso-
therm, dry soils typically exhibited nonlin-
ear isotherms and finite sorption kinetics.
Hydrogen-bonding compounds also dis-
played nonlinear isotherms and finite sorp-
tion and desorption  kinetics  in the  pres-
ence of water. A recalcitrant  fraction was
observed  to be resistant  to desorption,
especially with certain compounds in clays.

Research Accomplishments
  This  research has contributed to many
publications, reports, master's  theses, a
widely distributed video, and provided sup-
porting information  for many workshops
and conferences.

Publications
Houston,  S.L., Kreamer,  O.K. and R.
   Marwig, 1989.  A Batch-Type  Testing
   Method for Determination of Adsorp-
   tion  of  Gaseous  Compounds on  Par-
   tially Saturated  Soils.  Geotechnical
   Testing Journal,  ASTM, March 1989,
   p.3-10.

Houston,  S.L.  and  O.K. Kreamer, 1989.
   Effect of Temperature on the Potential
   for Gaseous Adsorption  by Partially
   Saturated Soils,  Engineering Geology
   and Geotechnical Engineering, Watters
   (ed.)   p.357-361.   A.A.  Balkema/
   Rotterdam/Brook,  Hardbound, ISBN 90
   6191 8782.

James, D. E, Kreamer, O.K., Sabapathi,
   J. and V. Rajagopalan,  1996a. Effects
   of Vertical Water Table Fluctuations on
   LNAPL Distribution in Porous Media,
   1. Effects of Varying Water Table Rise
   Rates in Initially Dry Sand. J.  of Con-
   taminant Hydrology. Accepted 1995 for
   Publication in 1996.

James, D. E, Kreamer, O.K., Rajagopalan,
   V. and S.K. Steinberg, 1996b. Effects
   of Vertical Water Table Fluctuations on
   LNAPL Distribution in Porous Media,
   2. Effects of Varying Grain Size in  Ini-
   tially  Moist Sands.  J.  of Contaminant
   Hydrology. Accepted 1995 for Publica-
   tion in 1996.

Johnson, T.E.  and O.K.  Kreamer, 1994.
   Physical and Mathematical Modeling of
   Diesel  Fuel Liquid  and Vapor Move-
   ment in Porous Media. Ground Water,
   Vol. 32, No. 4., p. 551-560.

Kreamer, O.K., Brown, C. and D. Sloop,
   1996.  Report  on  the Suitability  of
   PetroSenseฎ Probes  for Leak Detec-
   tion at Contaminated Sites.  Las Vegas,
   NV, March 1996.

Kreamer, O.K., Oja K.J.,  Steinberg, S.M.,
   and  H. Phillips,  1994. Vapor Adsorp-
   tion of a Solvent on Quartz Sands of
   Varying Grain Size.  Journal of Environ-
   mental Engineering, ASCE, Vol. 120,
   No. 2, p. 348-358.

Kreamer,  O.K.,  Starr,  K.,  Cogent,  S.,
   Johnson,  T. and H.A. Phillips, 1990.
   Gasoline Vapor Compound Ratios as
   a  Tool to  Locate Subsurface Fuel
   Leaks; from Minimizing Risk to the Hy-
   drologic Environment,  Selected Papers
   from  the American  Institute of Hydrol-
   ogy Conference,  Las  Vegas, Nevada,
   March  13-15,  1990,   p.243-249.
   Soft bound.

Kreamer, O.K. and K.J. Stetzenbach, 1990.
   Development of a Standard, Pure-Com-
   pound Base Gasoline Mixture  for Use
   as a Reference in Field and Laboratory
   Experiments. Ground Water Monitor-
   ing Review, Spring 1990, p. 135-145.

Oja,  K.J.  and  O.K.  Kreamer,  1992.  (In-
   vited  Paper). The Effect of Moisture on
   Adsorption of Trichloroethylene Vapor
   on  Natural Soils. Proceedings of  the
   U. S.  Environmental Protection Agency
   and National Center for Ground Water
   Research Symposium on Soil Venting,
   April  29 - May 1, 1991, Houston, TX, p
   13-28. Softbound.

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Steinberg,  S.M.,  Fairley, J.  and  O.K.
   Kreamer, 1994.  Slow Desorption of
   Toluene from Several  Ion-Exchanged
   Montmorillonites.  J.Soil Contamination
   3(3):249-264.

Steinberg, S.M. and  O.K. Kreamer, 1992.
   Determination of Sorption Isotherms for
   Volatile  Organic  Compounds on  Soil
   using Gas Chromatography. Structure,
   Bonding, and Kinetics  at Mineral Sur-
   faces Symposium, American Chemical
   Society,  April 5-10,  1992,  San Fran-
   cisco.

Steinberg, S.M. and  O.K. Kreamer, 1993.
   Persistence of Several Volatile Organic
   Compounds in a Low Organic Carbon,
   Calcareous Soil from Southern Nevada.
   Proceedings of the National Sympo-
   sium on Measuring and Interpreting
   VOCs in Soils: State  of the Art  and
   Research Needs.  U.S. Environmental
   Protection Agency, Jan. 12-14, Las Ve-
   gas, NV.

Steinberg, S.M. and  O.K. Kreamer, 1994.
   Determination of Sorption Isotherms for
   Volatile  Organic  Compounds on  Un-
   saturated Calcareous Soil from South-
   ern Nevada Using Inverse Chromatog-
   raphy.  Environmental Science  and
   Technology. Vol. 27, No. 5,  883-888.


Videos
  Two short videos were produced: Physi-
cal  Modeling of Subsurface Fuel Migra-
tion by Controlled Laboratory Tests  (10
mins) and Effects of Vertical Water Table
Fluctuations on LNAPL Distribution  (14
mins). These videos  have been shown at
approximately 65 conferences and work-
shops. On  request,  they have been  dis-
tributed to approximately 700 people.


Theses
  Master's  theses supported are:
  a) from the  University of Nevada,  Las
Vegas:

  •  Fairley, J., 1993.  Desportion Hysteresis
    in  Five Ion Exchanged Montmorillo-
    nites. Master of Science Thesis. Water
    Resources, Department  of Geo-
    science, UNLV.
  •  Rajagopalan, V., 1995. Influence of Grain
    Size  of a  Porous Medium  on  the
    Movement of Diesel Fuel  Due to
    Water  Table Fluctuations. Master of
    Science thesis. Water Resources,  De-
    partment of Geoscience, UNLV.
  •  Sabapathi, J., 1993. Effect of Water
    Table  Fluctuations on Petroleum
    Contamination Distribution.  Master of
    Science Thesis. Water Resources,
    Department of Geoscience, UNLV.
  •  Schmeltzer, J.,  1993. Effects of Soil
    Moisture, Soil Carbonate and Organic
    Matter Content on Vapor Phase Sorp-
    tion of Volatile  Organic Compounds
    Using Inverse Gas Chromatography.
    Master of Science Thesis. Water Re-
    sources, Department of Geoscience,
    UNLV.
  •  Squire, J., 1996.  Effect of Unsaturated
    Zone Soil Moisture Content on Vapor
    Phase  Pollutant Propagation in Con-
    trolled Laboratory  Experiments. Mas-
    ter  of  Science  Thesis. Water  Re-
    sources, Department of Geoscience,
    UNLV.
  •  Starr,  K., 1993.  Sand Tank Modeling
    of Hydrocarbon Migration  Design,
    Construction,  and  Testing.  Master of
    Science Thesis. Water Resources,
    Department of Geoscience, UNLV.
  b) from Arizona State University

  •  Chaganti, S.,  1990.  Vapor Transport
    Modeling in  Simulated  Leaking  Un-
    derground  Storage Tank  Environ-
    ments. Master of Science Thesis. De-
    partment of Civil Engineering, ASU.
  •  Johnson, T.,  1991.  Modeling  Diesel
    Vapor Transport In a Simulated Un-
    derground Environment. Master of
    Science Thesis. Department  of Civil
    Engineering, ASU.

Instruction/Technology
Transfer
  Conferences, lecture  series, training,
and workshops where information from
this research has been presented include:
  •  Superfund University Training  Insti-
    tute (SUTI) - approximately 6 courses,
    U.S. EPA
  •  DNAPL National Workshop Series -
    10 courses, U.S. EPA
  •  Monitoring Well  Design  National Se-
    ries - 10 courses, U.S. EPA
  •  Landfills RCRA Subtitle D National
    and International Series  -15 courses,
    U.S. EPA
  •  U.S. Bureau  of Land  Management
    Hazardous  Waste  Training  -  5
    courses. U.S. BLM
  •  Pesticide  Managers Training,  UC
    Davis Extension - 5 courses, U.S.
    EPA
  •  National  Educational courses  -  25
    courses,  National Ground Water As-
    sociation  and Environmental  Educa-
    tion Enterprises
  •  Many National and International Con-
    ferences

Project Conclusions and
Recommendations
  This work supports the contention that
vapor monitoring around underground stor-
age tanks is  beneficial to leak detection
efforts. Problems with the even,  radially
outward propagation of gases can  exist.
For example, this  research  has shown
that dry  materials  tend  to sorb vapors,
and a recalcitrant fraction, resistant to de-
sorption,  can  be formed. Organic materi-
als  in  soils tested did  not demonstrate
sorptive capacities that would make them
effective barriers to vapor migration. Fiber
optic  probes  showed some  promise  as
monitoring devices in varying degrees of
vapor saturation.
  In sand tank models, colorimetric analy-
sis of dyes, added to leaked fuels, showed
correlation to measured hydrocarbon con-
centrations, but the disparity  is generally
too  great between  dye  color and  hydro-
carbon concentration to rely on for quanti-
tative  work in  scientific studies.  In experi-
ments  run with air-dried  porous material
overlying a LNAPL pool floating on a wa-
ter table, unexpected isolation of product
occurred in situations where the water
table was raised.  The distribution  of en-
trapped hydrocarbon was observed to  be
much  more irregular than similar situa-
tions where the vadose  zone was origi-
nally moist. This suggests the potential  for
unusual hydrocarbon entrapment when the
water  table rises  in conditions where va-
por extraction (enhanced volatilization)
techniques have  been conducted in  an
overlying vadose zone. This situation may
occur  with remediation techniques that in-
volve  the combination of dewatering and
vapor extraction. Little is known about the
physics of interfacial interactions  in soils
of varying moisture content, and a recom-
mendation from this work is that this  be
investigated further.

Acknowledgments
  The Principal  Investigators,  David  K.
Kreamer and  David E. James, would like
to extend our appreciation to our students,
without whose efforts the  research would
not be complete. We also extend our grati-
tude to the University of Nevada,  LV  for
funding  distribution of the research vid-
eos.

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United States
Environmental Protection Agency
Center for Environmental Research Information (G-72)
Cincinnati, OH 45268

Official Business
Penalty for Private Use $300
     BULK RATE
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         EPA
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