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Volumn , Issue 11, 2005, Pages 2120-2123

On the redox chemistry of GeI bromide

Author keywords

Cage compounds; DFT calculations; Germanium; Redox reactions

Indexed keywords

ACETONE; CONDENSATION REACTIONS; GERMANIUM; GERMANIUM COMPOUNDS; SYNTHESIS (CHEMICAL);

EID: 20444488869     PISSN: 14341948     EISSN: None     Source Type: Journal    
DOI: 10.1002/ejic.200400843     Document Type: Article
Times cited : (15)

References (25)
  • 15
    • 4243402296 scopus 로고
    • Quantum chemical calculations were carried out with the RI-DFT version of the Turbomole program package, by employing the Becke-Perdew 86-functional. The basis sets were of SVP quality. Turbomole: O. Treutier, R. Ahlrichs, J. Chem. Phys. 1995, 102, 346;
    • (1995) J. Chem. Phys. , vol.102 , pp. 346
    • Treutier, O.1    Ahlrichs, R.2
  • 16
    • 5944261746 scopus 로고
    • BP-86 functional
    • BP-86 functional: J. P. Perdew, Phys. Rev. B 1986, 33, 8822;
    • (1986) Phys. Rev. B , vol.33 , pp. 8822
    • Perdew, J.P.1
  • 20
    • 85153246901 scopus 로고    scopus 로고
    • note
    • 2) is then used as starting point for the calculations.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.