DICP OpenIR

Browse/Search Results:  1-2 of 2 Help

Filters    
Selected(0)Clear Items/Page:    Sort:
Theoretical study on the ClO/ClO- system electron-transfer reactivity by the golden-rule 期刊论文
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 2003, 卷号: 629, 页码: 105-115
Authors:  Yan, SH;  Bu, YX;  Qin, M;  Sun, LX;  Han, K
Adobe PDF(174Kb)  |  Favorite  |  View/Download:190/72  |  Submit date:2010/11/30
Electron-transfer Reactivity  Golden-rule  Ub3ylp  Encounter-complex  Electron Coupling Matrix Element  clo+clo- System  
Golden-rule treatment on the ClO/ClO+ electron-transfer system 期刊论文
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 2003, 卷号: 629, 页码: 151-163
Authors:  Yan, SH;  Bu, YX;  Qin, M;  Sun, LX;  Han, KL
Adobe PDF(263Kb)  |  Favorite  |  View/Download:186/73  |  Submit date:2010/11/30
Electron-transfer Reactivity  Golden-rule  B3lyp  Encounter-complex  Electron Coupling Matrix Element  clo+clo+ System