Ab initio molecular orbital calculations on the boson peak frequencies of molecular glasses

Progress of Theoretical Physics Supplement

Volumn , Issue 126, 1997, Pages 147-150

  Uchino, Takashi ^a   Yoko, Toshinobu ^a  

^a KYOTO UNIVERSITY   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0031479967     PISSN: 03759687     EISSN: None     Source Type: Journal    
DOI: 10.1143/PTPS.126.147     Document Type: Article

References (7)

1. M. D. Ediger, C. A. Angell and S. R. Nagel, J. Phys. Chem. 100 (1996), 13200.
2. A. P. Sokolov, A. Kisliuk, M. Soltwisch and D. Quitmann, Phys. Rev. Lett. 69 (1992), 1540.
3. T. Uchino and T. Yoko, J. Chem. Phys. 105 (1996), 4140.
4. T. Uchino and T. Yoko, Science 273 (1996), 480.
5. W. J. Hehre, R. Ditchfield and J. A. Pople, J. Chem. Phys. 56 (1972), 2257.
6. M. J. Frisch et al., Gaussian 94, Revision B3 (Gaussian Inc., Pittsburgh, 1995).
7. O. Yamamuro, T. Matsuo, K. Takeda, T. Kanaya, T. Kawaguchi and K. Kaji, J. Chem. Phys. 105 (1996), 732.