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Volumn 43, Issue 20, 2004, Pages 6414-6420

Vanadium 7,7,8,8-tetracyano-p-quinodimethane (V[TCNQ]2)-based magnets

Author keywords

[No Author keywords available]

Indexed keywords

ALKYL GROUP; BROMINE; HYDROGEN; METHANE; METHYL GROUP; OXYGEN; UNCLASSIFIED DRUG; VANADIUM; VANADIUM 7,7,8,8 TETRACYANO 4 QUINODIMETHANE; VANADIUM DERIVATIVE;

EID: 4744357241     PISSN: 00201669     EISSN: None     Source Type: Journal    
DOI: 10.1021/ic049552z     Document Type: Article
Times cited : (80)

References (58)
  • 1
    • 4744354031 scopus 로고
    • Proceedings of the conference on Ferromagnetic and High Spin Molecular Based Materials; Miller, J. S., Dougherty, D., Eds.
    • (a) In Molecular Crystals and Liquid Crystals, Proceedings of the conference on Ferromagnetic and High Spin Molecular Based Materials; Miller, J. S., Dougherty, D., Eds.; 1989; Vol. 176.
    • (1989) Molecular Crystals and Liquid Crystals , vol.176
  • 2
    • 4744340080 scopus 로고
    • Proceedings of the conference on Molecular Magnetic Materials; Kahn, O., Gatteschi, D., Miller, J. S., Palacio, F., Eds.
    • (b) In NATO ARW Molecular Magnetic Materials, Proceedings of the conference on Molecular Magnetic Materials; Kahn, O., Gatteschi, D., Miller, J. S., Palacio, F., Eds.; 1991; Vol. E198.
    • (1991) NATO ARW Molecular Magnetic Materials , vol.E198
  • 3
    • 4744364751 scopus 로고
    • Proceedings of the conference on the Chemistry and Physics of Molecular Based Magnetic Materials; Iwamura, H., Miller, J. S., Eds.
    • (c) In Molecular Crystals and Liquid Crystals, Proceedings of the conference on the Chemistry and Physics of Molecular Based Magnetic Materials; Iwamura, H., Miller, J. S., Eds.; 1993; Vol. 232/233.
    • (1993) Molecular Crystals and Liquid Crystals , vol.232-233
  • 4
    • 4744354032 scopus 로고
    • Proceedings of the conference on Molecule-based Magnets; Miller, J. S., Epstein, A. J., Eds.
    • (d) In Molecular Crystals and Liquid Crystals, Proceedings of the conference on Molecule-based Magnets; Miller, J. S., Epstein, A. J., Eds.; 1995; Vol. 271-274.
    • (1995) Molecular Crystals and Liquid Crystals , vol.271-274
  • 5
    • 4744359920 scopus 로고    scopus 로고
    • Proceedings of the conference on Molecular-Based Magnets; Itoh, K., Miller, J. S., Takui, T., Eds.
    • (e) In Molecular Crystals and Liquid Crystals, Proceedings of the conference on Molecular-Based Magnets; Itoh, K., Miller, J. S., Takui, T., Eds.; 1997; Vol. 305/306.
    • (1997) Molecular Crystals and Liquid Crystals , vol.305-306
  • 20
    • 0344335388 scopus 로고
    • (b) Epstein, A. J.; Miller, J. S. In the Proceedings of Nobel Symposium NS-81 Conjugated Polymers and Related Materials: The Interconnection of Chemical and Electronic Structure; Oxford University Press: Oxford, 1993, p 475; La Chim. La Ind. 1993, 75, 185, 257.
    • (1993) La Chim. La Ind. , vol.75 , pp. 185
  • 22
    • 0242393291 scopus 로고
    • (c) Miller, J. S.; Yee, G. T.; Manriquez, J. M.; Epstein, A. J. In the Proceedings of Nobel Symposium NS-81 Conjugated Polymers and Related Materials: The Interconnection of Chemical and Electronic Structure; Oxford University Press: Oxford, 1993, p 461; La Chim. La Ind. 1992, 74, 845.
    • (1992) La Chim. La Ind. , vol.74 , pp. 845
  • 40
    • 0041838368 scopus 로고
    • Miller, J. S.; Kravitz, S. H.; Kirschner, S.; Ostrowski, P.; Nigrey, P. J. J. Chem. Educ. 1977, 55, 181; Quant. Chem. Prog. Exch. 1977, 10, 341.
    • (1977) Quant. Chem. Prog. Exch. , vol.10 , pp. 341
  • 41
    • 0000189651 scopus 로고
    • The B3LYP is a combination of the nonlocal three parameters exchange functional [Becke, A. D. J. Chem. Phys. 1993, 98, 5648] and nonlocal LYP correlation functional [Lee, C.; Yang, W.; Parr, R. G. Phys. Rev. B 1998, 37, 785].
    • (1993) J. Chem. Phys. , vol.98 , pp. 5648
    • Becke, A.D.1
  • 42
    • 0345491105 scopus 로고    scopus 로고
    • The B3LYP is a combination of the nonlocal three parameters exchange functional [Becke, A. D. J. Chem. Phys. 1993, 98, 5648] and nonlocal LYP correlation functional [Lee, C.; Yang, W.; Parr, R. G. Phys. Rev. B 1998, 37, 785].
    • (1998) Phys. Rev. B , vol.37 , pp. 785
    • Lee, C.1    Yang, W.2    Parr, R.G.3
  • 56
    • 4744368871 scopus 로고    scopus 로고
    • note
    • .- (R = Me, i-Pr, Et OPh), the symmetry of the geometry-optimized structure is not preserved for C1, C2, C3, and C4; hence, the reported values are an average over C1′, C2′, C3′, and C4′, respectively, (a) Fixing the symmetry did not correct the problem, (b) The maximum difference between the α and β electron populations was only 0.004 for C1 of R = OPh.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.