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Theoretical studies on electronic spectra and second-order nonlinear optical properties of barbituric acid derivatives substituted with schiff base

✍ Scribed by Gang Sun; Yong-Qing Qiu; Hai-Zhu Sun; Zhong-Min Su; Jing-Dong Feng; Yu-Lan Zhu

Publisher
John Wiley and Sons
Year
2010
Tongue
English
Weight
347 KB
Volume
22
Category
Article
ISSN
0256-7660

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πŸ“œ SIMILAR VOLUMES

Theoretical Studies on Electronic Spectr
Theoretical Studies on Electronic Spectra and Second-order Nonlinear Optical Properties of Glucosyl Substituted Barbituric Acid Derivatives
✍ Jing-Dong Feng; Li-Kai Yan; Zhong-Min Su; Yu-He Kan; Ya-Qian Lan; Yi Liao; Yu-La πŸ“‚ Article πŸ“… 2006 πŸ› John Wiley and Sons 🌐 English βš– 125 KB

## Abstract AM1 semi‐empirical method was used to optimize the barbituric acid derivatives substituted with glucosyl **B**~1–5~(series **B**), and the thiobarbituric acid derivatives substituted with glucosyl **T**~1–5~ (series**T**). Based on the optimized structures, INDO/CI method was adopted to