Study on cellulose degradation induced by hydroxyl radical with cellobiose as a model using GC–MS, ReaxFF simulation and DFT computation-Reference-Cited by-同舟云学术

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Study on cellulose degradation induced by hydroxyl radical with cellobiose as a model using GC–MS, ReaxFF simulation and DFT computation

Published:2020-04 Issue: Volume:233 Page:115677
ISSN:0144-8617
Container-title:Carbohydrate Polymers
language:en
Short-container-title:Carbohydrate Polymers

Author:

Shao Chunfu,Shao Qiang,Wang Xiaoyi,Ling Jun,Guo Xiao,Ning Yulin,Dai Yujie,Jia Shiru,Qiao Yuanyuan,Li Changwen,Zhao Kai

Funder

Natural Science Foundation of Tianjin City

Tianjin science and technology plan project

Publisher

Elsevier BV

Subject

Materials Chemistry,Polymers and Plastics,Organic Chemistry

Reference65 articles.

1. Manganoporphyrin-polyphenol multilayer capsules as radical and reactive oxygen species (ROS) scavengers;Alford;Chemistry of Materials,2018

2. Thermal decomposition of HFO-1234yf through ReaxFF molecular dynamics simulation;Cao;Applied Thermal Engineering,2017

3. Adaptive accelerated ReaxFF reactive dynamics with validation from simulating hydrogen combustion;Cheng;Journal of the American Chemical Society,2014

4. ReaxFF reactive force field for molecular dynamics simulations of hydrocarbon oxidation;Chenoweth;The Journal of Physical Chemistry A,2008

5. Qualitation and quantification of specific polysaccharides from Panax species using GC-MS, saccharide mapping and HPSEC-RID-MALLS;Cheong;Carbohydrate Polymers,2016

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