✦ LIBER ✦

TDDFT Study of the Electronic Structure, Absorption and Emission Spectra of the Light Emitters of the Amazing Firefly Bioluminescence and Solvation Effects on the Spectra

✍ Scribed by Ai-Min REN; Jing-Fu GUO; Ji-Kang FENG; Lu-Yi ZOU; Zhong-Wei LI; John David GODDARD

Publisher: John Wiley and Sons
Year: 2008
Tongue: English
Weight: 245 KB
Volume: 26
Category: Article
ISSN: 0256-7660
DOI: 10.1002/cjoc.200890038

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Theoretical Study on the Structures and

Theoretical Study on the Structures and Electronic Spectra of TCNE2−

✍ Inmaculada García Cuesta; José Sánchez-Marín; Alfredo M. J. Sánchez de Merás 📂 Article 📅 2006 🏛 John Wiley and Sons 🌐 English ⚖ 98 KB 👁 3 views

Paradoxical Solvent Effects on the Absor

Paradoxical Solvent Effects on the Absorption and Emission Spectra of Amino-Substituted Perylene Monoimides

✍ Peter D. Zoon; Albert M. Brouwer 📂 Article 📅 2005 🏛 John Wiley and Sons 🌐 English ⚖ 175 KB 👁 1 views

Theoretical studies on the structures an

Theoretical studies on the structures and electronic spectra of C70CH2

✍ Qiwen Teng; Xuezhuang Zhao; Zun-Sheng Cai; Au Chin Tang 📂 Article 📅 1997 🏛 John Wiley and Sons 🌐 English ⚖ 174 KB 👁 2 views

Intermediate neglect of differential overlap INDO calculations were used to study the structure of C CH . It was found that the CH group is mainly added to the C ᎏC 70 2 2 I II Ž . C represents the first kind of carbon atom and so on or the C ᎏC bond in C and I III III 70 a cyclopropane feature with

Effect of Peripheral Substitution on the

Effect of Peripheral Substitution on the Electronic Absorption and Fluorescence Spectra of Metal-Free and Zinc Phthalocyanines

✍ Nagao Kobayashi; Hiroshi Ogata; Naokazu Nonaka; Eugene A. Luk'yanets 📂 Article 📅 2003 🏛 John Wiley and Sons 🌐 English ⚖ 311 KB 👁 1 views

## Abstract The effect of substituents on the position and intensity of the electronic absorption and fluorescence spectra of phthalocyanines (Pcs) was examined for 35 Pc compounds. When electron‐releasing groups are bound to four __α__‐benzo positions of the Pc skeleton, the B and Q bands shift to

Theoretical study on the structures and

Theoretical study on the structures and electronic spectra of C120On (n=1,2)

✍ WeiQuan Tian; AiMin Ren; JiKang Feng; JingFu Guo; ChiaChung Sun 📂 Article 📅 2000 🏛 John Wiley and Sons 🌐 English ⚖ 449 KB 👁 2 views

Theoretical study on the structures and

Theoretical study on the structures and electron spectra of C60M12 (M=Li, Na, Be)

✍ Auchin Tang; Zhenfeng Shang; Qiwen Teng; Yinming Pan; Zunsheng Cai; Xuezhuang Zh 📂 Article 📅 1999 🏛 John Wiley and Sons 🌐 English ⚖ 146 KB 👁 2 views

Intermediate neglect of differential overlap INDO method was used to Ž . study the structures and the electronic spectra of C M M s Li, Na, Be . The 60 12 Ž . calculations indicate that in the minimal energy configuration of C M M s Li, Na 60 12 the C cage still retains I symmetry and the 12 Li or N