Separation and Purification Technology, Journal Year: 2023, Volume and Issue: 329, P. 125195 - 125195
Published: Sept. 28, 2023
Language: Английский
Separation and Purification Technology, Journal Year: 2023, Volume and Issue: 329, P. 125195 - 125195
Published: Sept. 28, 2023
Language: Английский
Process Safety and Environmental Protection, Journal Year: 2023, Volume and Issue: 171, P. 847 - 858
Published: Feb. 3, 2023
Language: Английский
Citations
66Chemical Engineering Journal, Journal Year: 2023, Volume and Issue: 464, P. 142562 - 142562
Published: March 22, 2023
Language: Английский
Citations
50Chemical Engineering Journal, Journal Year: 2024, Volume and Issue: 489, P. 151263 - 151263
Published: April 12, 2024
Language: Английский
Citations
32Separation and Purification Technology, Journal Year: 2024, Volume and Issue: 339, P. 126740 - 126740
Published: Feb. 10, 2024
Language: Английский
Citations
27Chemosphere, Journal Year: 2024, Volume and Issue: 351, P. 141153 - 141153
Published: Jan. 12, 2024
Language: Английский
Citations
25Chemosphere, Journal Year: 2023, Volume and Issue: 339, P. 139672 - 139672
Published: July 28, 2023
Language: Английский
Citations
28ACS ES&T Engineering, Journal Year: 2023, Volume and Issue: 4(1), P. 4 - 18
Published: July 23, 2023
Advanced oxidation processes (AOPs) have a broad range of potential applications in the treatment emerging refractory pollutants. However, due to presence highly reactive substances such as free radicals that are difficult capture, it is challenging investigate mechanism AOPs at elementary reaction level. The conventional methods, electron spin resonance (ESR), radical quantification, and quenching, plagued by systematic issues led bottlenecks field AOP studies. development computational chemistry theory computer performance provides new method study through density functional (DFT) calculation. Due its excellent cost–performance benefit, DFT calculations for aperiodic small molecules become popular AOPs. In this paper, comprehensive review presented on predicting active sites exploring selectivity oxidant activation mechanisms. A classification methods related molecular descriptors transition states provided. Furthermore, some current research identified, future prospects challenges discussed.
Language: Английский
Citations
25Chemical Engineering Science, Journal Year: 2024, Volume and Issue: 291, P. 119945 - 119945
Published: Feb. 27, 2024
Language: Английский
Citations
15Process Safety and Environmental Protection, Journal Year: 2024, Volume and Issue: 187, P. 622 - 643
Published: May 7, 2024
Language: Английский
Citations
15Separation and Purification Technology, Journal Year: 2024, Volume and Issue: 342, P. 126905 - 126905
Published: Feb. 25, 2024
Language: Английский
Citations
13