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Volumn 113, Issue 13, 2009, Pages 5141-5149

Charged states of four isomers of C84 fullerene: In situ ESR and Vis-NIR spectroelectrochemistry and DFT calculations

Author keywords

[No Author keywords available]

Indexed keywords

ANIONIC SPECIES; CHARGED STATE; DENSITY FUNCTIONAL THEORY CALCULATIONS; DFT CALCULATIONS; ELECTRON SPIN RESONANCE SPECTRUM; ELECTRON SPIN RESONANCES; ESR SPECTRUM; EXPERIMENTAL SPECTRUM; FULLERENE IONS; FULLERENE ISOMERS; IN-SITU; MONOANION; NEAR-INFRARED ABSORPTIONS; O-DICHLOROBENZENE; OPTICAL SPECTRUM; REDOX PROPERTIES; ROOM TEMPERATURES; SPECTROSCOPIC DATUM; SPIN DENSITY DISTRIBUTIONS; TIME-DEPENDENT DFT;

EID: 65249139409     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp811274g     Document Type: Article
Times cited : (16)

References (27)
  • 19
    • 65249104869 scopus 로고    scopus 로고
    • Barone, V. EPR-II Structure, Magnetic Properties and Reactivities of Open-Shell Species from Density Functional and Self-Consistent Hybrid Methods. In Recent Advances in Density Functional Methods, Part 1; Chong, D. P., Ed.; World Scientific: Singapore, 1995; p 287.
    • Barone, V. EPR-II Structure, Magnetic Properties and Reactivities of Open-Shell Species from Density Functional and Self-Consistent Hybrid Methods. In Recent Advances in Density Functional Methods, Part 1; Chong, D. P., Ed.; World Scientific: Singapore, 1995; p 287.
  • 20
    • 65249187217 scopus 로고    scopus 로고
    • Granovsky, A. A. PC GAMESS, Firefly version 7.1.E;, 2008
    • Granovsky, A. A. PC GAMESS, Firefly version 7.1.E; http://classic.chem.msu.su/gran/gamess/index.html, 2008.
  • 23
    • 55449133848 scopus 로고    scopus 로고
    • Zalibera, M.; Popov, A. A.; Kalbac, M.; Rapta, P.; Dunsch, L. Chem.sEur. J. 2008, 14 (32), 9960-9967.
    • Zalibera, M.; Popov, A. A.; Kalbac, M.; Rapta, P.; Dunsch, L. Chem.sEur. J. 2008, 14 (32), 9960-9967.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.