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Volumn 45, Issue 13, 2006, Pages 2107-2111

Isolation and characterization of Sc2C2@C 68: A metal-carbide endofullerene with a non-IPR carbon cage

Author keywords

Density functional calculations; Fullerenes; Host guest systems; Scandium; Structure elucidation

Indexed keywords

CARBON; FULLERENES; MOLECULAR STRUCTURE; PROBABILITY DENSITY FUNCTION; SYNTHESIS (CHEMICAL);

EID: 33745690691     PISSN: 14337851     EISSN: None     Source Type: Journal    
DOI: 10.1002/anie.200503705     Document Type: Article
Times cited : (173)

References (43)
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    • Kroto, H.W.1
  • 10
  • 22
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    • a) H. W. Kroto, Nature 1987, 329, 529;
    • (1987) Nature , vol.329 , pp. 529
    • Kroto, H.W.1
  • 29
    • 0000189651 scopus 로고
    • For the hybrid density functional B3LYP method, see a) A. D. Becke, J. Chem. Phys. 1993, 98, 5648;
    • (1993) J. Chem. Phys. , vol.98 , pp. 5648
    • Becke, A.D.1
  • 33
    • 34447260582 scopus 로고
    • 3 code implemented in Material Studio, Accelrys Inc.: a) B. Delley, J. Chem. Phys. 1990, 92, 508;
    • (1990) J. Chem. Phys. , vol.92 , pp. 508
    • Delley, B.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.