Topology-Enhanced Diffusion of Chemical Warfare Agents in Metal-Organic Frameworks for Detoxification

Abstract

The safe and efficient detoxification of chemical warfare agents (CWAs), including phosphorous based nerve agents and sulfur mustard gas, is critical to eliminate dangerous stockpiles and protect both civilians and soldiers. As new materials are developed to destroy these toxic compounds, it is important to understand how the 3-dimensional structure of materials influences the diffusion and movement of CWAs throughout the material. We will use computer modeling and experimental measurements to determine the structural components that allow for optimal diffusion, stability, and CWA uptake. With this knowledge, we will develop guidelines for the design of superior materials capable of safe and rapid CWA detoxification.

Document Details

Document Type
DoD Grant Award
Publication Date
Aug 01, 2019
Source ID
HDTRA11910007

Entities

People

  • Omar Farha

Organizations

  • Defense Threat Reduction Agency
  • Northwestern University

Tags

Readers

  • Analytical Chemistry
  • Environmental Engineering.
  • Nanocomposite Materials Science