A relationship between membrane permeation and partitioning of nitroaromatic explosives and their functional groups. A computational study-Reference-Cited by-同舟云学术

A relationship between membrane permeation and partitioning of nitroaromatic explosives and their functional groups. A computational study

Published:2020 Issue:16 Volume:22 Page:8791-8799
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Yang Hong¹²³⁴⁵,Li Huarong⁵⁶⁷⁴,Zhou Mi⁵⁶⁷⁴,Wei Tong⁵⁶⁷⁴,Tang Can⁵⁶⁷⁴,Liu Liu⁵⁶⁷⁴,Zhou Yang⁵⁶⁷⁴^ORCID,Long Xinping⁵⁶⁷⁴

Affiliation:

1. School of Materials Science and Engineering

2. Tsinghua University

3. Beijing 100084

4. China

5. Institute of Chemical Materials

6. China Academy of Engineering and Physics

7. Mianyang 621900

Abstract

Nitroaromatic explosives, such as 2,4,6-trinitrotoluene, are representative aromatic compounds, which are generally highly toxic.

Funder

National Natural Science Foundation of China

China Academy of Engineering Physics

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2020/CP/D0CP00549E

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