Category Ranking

98%

Total Visits

921

Avg Visit Duration

2 minutes

Citations

20

Article Abstract

A reactive barrier that consisted of vegetable compost, iron oxide and clay was installed in an infiltration basin to enhance the removal of emerging organic compounds (EOCs) in the recharge water. First-order degradation rates and retardation factors were jointly estimated for 10 compounds using a multilayer reactive transport model, whose flow and conservative transport parameters were previously estimated using hydraulic head values and conservative tracer tests. Reactive transport parameters were automatically calibrated against the concentration of EOCs measured at nine monitoring points. The degradation rate of each compound was estimated for three zones defined according to the redox state, and retardation coefficients were estimated in two zones defined according to the organic matter content. The fastest degradation rates were obtained for the reactive barrier, and the estimated values were similar to or higher than those estimated in column and/or field experiments for most of the compounds (8/10). Estimated retardation coefficients in the reactive barrier were higher than in the rest of the aquifer in most cases (8/10) and higher than those values estimated in previous studies. Based on the results obtained in this study the reactive barrier seems to be able to enhance the removal of EOCs.

Download full-text PDF

Source
http://dx.doi.org/10.1016/j.scitotenv.2017.08.054DOI Listing

Publication Analysis

Top Keywords

reactive barrier
20
enhance removal
8
degradation rates
8
estimated
8
reactive transport
8
transport parameters
8
zones defined
8
retardation coefficients
8
reactive
7
barrier
5

Similar Publications

Purpose: Glioblastoma (GBM) remains one of the most aggressive primary brain tumors with poor survival outcomes and a lack of approved therapies. A promising novel approach for GBM is the application of photodynamic therapy (PDT), a localized, light-activated treatment using tumor-selective photosensitizers. This narrative review describes the mechanisms, delivery systems, photosensitizers, and available evidence regarding the potential of PDT as a novel therapeutic approach for GBM.

View Article and Find Full Text PDF

Mechanistic insights into neosilyllithium-catalyzed hydroboration of nitriles, aldehydes, and esters: a DLPNO-CCSD(T) study.

Phys Chem Chem Phys

September 2025

Computational Inorganic Chemistry Group, Department of Chemistry, Indian Institute of Technology Hyderabad, Kandi, Sangareddy, Telangana 502284, India.

Over the past few years, alkali and alkaline earth metals have emerged as alternative catalysts to transition metal organometallics to catalyze the hydroboration of unsaturated compounds. A highly selective and cost-effective lithium-catalyzed method for the synthesis of an organoborane has been established based on the addition of a B-H bond to an unsaturated bond (polarized or unpolarized) using pinacolborane (HBPin). In the present work, the neosilyllithium-catalyzed hydroboration of nitriles, aldehydes, and esters has been investigated using high-level DLPNO-CCSD(T) calculations to unravel the mechanistic pathways and substrate-dependent reactivity.

View Article and Find Full Text PDF

In this study, we seek to deepen the understanding of the Fe effect in Ni-oxyhydroxide-mediated oxygen evolution reaction (OER) electrocatalysis in alkaline conditions, where extremely small amounts of Fe can have a dramatic impact on catalytic performance. For this purpose, Density Functional Theory (DFT) electronic structure calculations with implicit solvation description is employed in a constant pH/potential simulation framework. Nanoparticle models are considered for the nickel-based oxyhydroxide material with different degrees of Fe incorporation, and the pH/U-dependent interface structure is studied.

View Article and Find Full Text PDF

Delivering therapeutics across the blood-brain barrier (BBB) remains a major challenge in ischemic stroke therapy. Ischemic stroke induces upregulation of various inflammatory membrane receptors on brain endothelial cells, offering potential entry points for receptor-mediated transcytosis. This study proposes a universal targeting strategy by employing inflammatory pathway antagonists as targeting ligands, which broadens the spectrum of available ligands beyond traditional receptor-binding molecules.

View Article and Find Full Text PDF

Promotion of CO Reactivity by Organic Acid on Aerosol Surfaces.

J Am Chem Soc

September 2025

State Key Joint Laboratory of Environment Simulation and Pollution Control, Research Center for Eco-Environmental Sciences, Chinese Academy of Sciences, Beijing 100085, China.

Recently, the atmospheric aerosol surface, which is reported to be quite acidic, is recognized as an important microreactive medium for atmospheric chemistry, profoundly impacting air quality and global climate. Nevertheless, the molecular-level understanding of the effect of surface-bound acids on atmospheric chemical reactions remains limited. Herein, the reactions between CO and NH/amines at the air-water interface with organic acids are investigated using combined molecular dynamic simulations and quantum chemical calculations.

View Article and Find Full Text PDF