Jiri Simunek

Bio: Jiri Simunek is an academic researcher from University of California, Riverside. The author has contributed to research in topics: Colloid & Water flow. The author has an hindex of 12, co-authored 16 publications receiving 943 citations.

Soil Physics with HYDRUS : Modeling and Applications

Abstract: Soil Solid Phase Introduction Soil Phases Soil Texture Soil Mineralogy Soil Structure Summary Derivations Problems Soil Water Content and Potential Introduction Energy and Work Properties of Bulk Water Properties of Water at Air and Solid Interfaces Soil Water Content Measuring Soil Water Content Soil Water Potential Measuring Soil Water Potential Components The Soil Water Retention Curve RETC Program Summary Derivations Problems Steady Water Flow in Soils Introduction Steady Flow in Saturated Soil Steady Flow in Unsaturated Soil Measurements of Hydraulic Properties Summary Derivations Heat Flow in Soils Introduction Surface Energy Balance Steady Soil Heat Flux Transient Soil Heat Flux Soil Heat Flow with Hydrus-1d Summary Derivations Problems Transient Water Flow in Soils Introduction Transient Water Flow Numerical Solutions to the Richards Equation Infiltration Redistribution Evaporation Transpiration Preferential Flow Groundwater Recharge and Discharge Inverse Solutions and Parameter Optimization Summary Derivations Problems Solute Transport Introduction Conservation and Flux Equations Advection Dispersion Equation Stanmodand Cxtfit Numerical Approaches for Solute Transport HydrusExamples of Solute Transport Summary Derivations Problems Appendix References Index

Retention and remobilization of stabilized silver nanoparticles in an undisturbed loamy sand soil.

Abstract: Column experiments were conducted with undisturbed loamy sand soil under unsaturated conditions (around 90% saturation degree) to investigate the retention of surfactant stabilized silver nanoparticles (AgNPs) with various input concentration (Co), flow velocity, and ionic strength (IS), and the remobilization of AgNPs by changing the cation type and IS. The mobility of AgNPs in soil was enhanced with decreasing solution IS, increasing flow rate and input concentration. Significant retardation of AgNP breakthrough and hyperexponential retention profiles (RPs) were observed in almost all the transport experiments. The retention of AgNPs was successfully analyzed using a numerical model that accounted for time- and depth-dependent retention. The simulated retention rate coefficient (k1) and maximum retained concentration on the solid phase (Smax) increased with increasing IS and decreasing Co. The high k1 resulted in retarded breakthrough curves (BTCs) until Smax was filled and then high effluent concentrations were obtained. Hyperexponential RPs were likely caused by the hydrodynamics at the column inlet which produced a concentrated AgNP flux to the solid surface. Higher IS and lower Co produced more hyperexponential RPs because of larger values of Smax. Retention of AgNPs was much more pronounced in the presence of Ca(2+) than K(+) at the same IS, and the amount of AgNP released with a reduction in IS was larger for K(+) than Ca(2+) systems. These stronger AgNP interactions in the presence of Ca(2+) were attributed to cation bridging. Further release of AgNPs and clay from the soil was induced by cation exchange (K(+) for Ca(2+)) that reduced the bridging interaction and IS reduction that expanded the electrical double layer. Transmission electron microscopy, energy-dispersive X-ray spectroscopy, and correlations between released soil colloids and AgNPs indicated that some of the released AgNPs were associated with the released clay fraction.

Modeling colloid transport and retention in saturated porous media under unfavorable attachment conditions

Abstract: [1] A mathematical model is presented for colloid transport and retention in saturated porous media under unfavorable attachment conditions. The model accounts for colloid transport in the bulk aqueous phase and adjacent to the solid surface, and rates of colloid collision, interaction, release, and immobilization on the solid phase. Model parameters were estimated using (1) filtration theory; (2) calculated interaction energies in conjunction with the Maxwellian kinetic energy model of diffusion; (3) information about the velocity magnitude and distribution adjacent to the solid phase that was obtained from pore scale water flow simulations; (4) colloid and collector sizes; (5) the balance of applied hydrodynamic and resisting adhesive torques; and (6) time dependent filling of retention locations using a Langmuirian approach. The presented theory constrains the model parameters and output to physically realistic values in many instances, and minimizes the need for parameter optimization. Example simulations demonstrate that our modeling formulation is qualitatively consistent with observed trends for retention with colloid size and concentration, grain size, and velocity for many systems. The model provides a clear conceptual explanation for the causes of hyperexponential, exponential, uniform, and nonmonotonic retention profiles without invoking hypotheses with regard to colloid heterogeneity, aggregation, or multiple deposition rates. Furthermore, the model formulation and research presented herein helps to identify areas where additional research and theory development are still needed.

Dissolution and transport of TNT, RDX, and composition B in saturated soil columns.

Abstract: Low-order detonations and blow-in-place procedures on military training ranges can result in residual solid explosive formulations to serve as distributed point sources for ground water contamination. This study was conducted to determine if distribution coefficients from batch studies and transport parameters of pure compounds in solution adequately describe explosive transport where compounds are present as solid particles in formulations. Saturated column transport experiments were conducted with 2,4,6-trinitrotoluene (TNT), hexahydro-1,3,5-trinitro-1,3,5-triazine (RDX), and the explosive formulation, Composition B (Comp B) (59.5 +/- 2.0% RDX, 39.5 +/- 2.3% TNT, and 1% wax) in solid and dissolved forms. The two soils used were Plymouth loamy sand (mesic, coated Typic Quartzipsamments) from Camp Edwards, MA and Adler silt loam (coarse-silty, mixed, superactive, thermic Fluvaquentic Eutrudepts) from Vicksburg, MS. Interrupted flow experiments were used to determine if explosives were at equilibrium distribution between soil and solution phases. The HYDRUS-1D code was used to determine fate and transport parameters. Results indicated that sorption of high explosives was rate limited. The behavior of dissolved Comp B was similar to the behavior of pure TNT and RDX. Behavior of solid Comp B was controlled by dissolution that depended on physical properties of the Comp B sample. Adsorption coefficients determined by HYDRUS-1D were different from those determined in batch tests for the same soils. Use of parameters specific to formulations will improve fate and transport predictions.

The Environmental Protection Agency

Abstract: The Environmental Protection Agency (EPA) provides access to information on a variety of topics related to the environment and strives to inform citizens of health risks. The EPA also has an extensive library network that consists of 26 libraries throughout the United States, which provide access to a plethora of information to EPA employees, scientists, and researchers. The EPA implemented a reorganization project to digitize their materials so they would be more accessible to a wider range of users, but this plan was drastically accelerated when the EPA was threatened with a budget cut. It chose to close and reduce the hours and services of some of their libraries. As a result, the agency was accused of denying users the “right to know” by making information unavailable, not providing an adequate strategic plan, and discarding vital materials. This case study explores the background of the digitization project, the practices implemented, and the critiques of the project.

Development and Applications of the HYDRUS and STANMOD Software Packages and Related Codes

Abstract: Mathematical models have become indispensable tools for studying vadose zone flow and transport processes. We reviewed the history of development, the main processes involved, and selected applications of HYDRUS and related models and software packages developed collaboratively by several groups in the United States, the Czech Republic, Israel, Belgium, and the Netherlands. Our main focus was on modeling tools developed jointly by the U.S. Salinity Laboratory of the USDA, Agricultural Research Service, and the University of California, Riverside. This collaboration during the past three decades has resulted in the development of a large number of numerical [e.g., SWMS_2D, HYDRUS-1D, HYDRUS-2D, HYDRUS (2D/3D), and HP1] as well as analytical (e.g., CXTFIT and STANMOD) computer tools for analyzing water flow and solute transport processes in soils and groundwater. The research also produced additional programs and databases (e.g., RETC, Rosetta, and UNSODA) for quantifying unsaturated soil hydraulic properties. All of the modeling tools, with the exception of HYDRUS-2D and HYDRUS (2D/3D), are in the public domain and can be downloaded freely from several websites.

Recent Developments and Applications of the HYDRUS Computer Software Packages

Abstract: The HYDRUS-1D and HYDRUS (2D/3D) computer software packages are widely used finite-element models for simulating the one- and two- or three-dimensional movement of water, heat, and multiple solutes in variably saturated media, respectively. In 2008, Simůnek et al. (2008b) described the entire history of the development of the various HYDRUS programs and related models and tools such as STANMOD, RETC, ROSETTA, UNSODA, UNSATCHEM, HP1, and others. The objective of this manuscript is to review selected capabilities of HYDRUS that have been implemented since 2008. Our review is not limited to listing additional processes that were implemented in the standard computational modules, but also describes many new standard and nonstandard specialized add-on modules that significantly expanded the capabilities of the two software packages. We also review additional capabilities that have been incorporated into the graphical user interface (GUI) that supports the use of HYDRUS (2D/3D). Another objective of this manuscript is to review selected applications of the HYDRUS models such as evaluation of various irrigation schemes, evaluation of the effects of plant water uptake on groundwater recharge, assessing the transport of particle-like substances in the subsurface, and using the models in conjunction with various geophysical methods.

A Review of Silver Nanoparticles: Research Trends, Global Consumption, Synthesis, Properties, and Future Challenges

Abstract: Silver nanoparticles (AgNPs) are intensively investigated for their superior physical, chemical, and biological properties. A proper knowledge of these properties is essential to maximizing the potential applications of AgNPs in several areas while minimizing their risks to humans and the environment. This paper aims to critically review AgNPs from the perspectives of research trends, global consumption, synthesis, properties, and future challenges. Generally, AgNPs can be synthesized using three methods, namely physical, chemical, and biological, and the related works as well as their numerous advantages and disadvantages are presented in this review. In addition, AgNPs can be potentially explored for various applications. Future challenges on (AgNP) synthesis, their release into the environment, and scaling up production, as presented in the review, suggest that several potential topics for future works are available to promote a safer and more efficient use of these nanoparticles. Studies on AgNPs in Malaysia have increased since the Malaysian government officially established a directorate for nanotechnology development. This calls for a proper set of policies on AgNPs starting from their production to utilization as well as their effects on various related industries and the environment.