SCOPUS 정보 검색 플랫폼

Journal of Molecular Structure: THEOCHEM

Volumn 755, Issue 1-3, 2005, Pages 195-202

Vibrational analysis of the inelastic neutron scattering spectrum of tetracyanoethylene-hexamethylbenzene by electronic structure calculations

(2) Ciezak, Jennifer A a,b,c Hudson, Bruce S a

a SYRACUSE UNIVERSITY (United States)

b MS 8562 ^* (United States)

c U S ARMY RESEARCH LABORATORY (United States)

Author keywords

Electron donor acceptor complexes; Inelastic neutron scattering; TCNE HMB; Tetracyanoethylene Hexamethylbenzene; Vibrational spectroscopy

Indexed keywords

EID: 29044449579 PISSN: 01661280 EISSN: None Source Type: Journal
DOI: 10.1016/j.theochem.2005.08.023 Document Type: Article

Times cited : (8)

References (42)

1
- 0037341218
- K. Wu, J. Li, C. Lin, C. Mang, and B. Zhaung Appl. Phys. A 76 2003 427
- (2003) Appl. Phys. a , vol.76 , pp. 427
- Wu, K.¹ Li, J.² Lin, C.³ Mang, C.⁴ Zhaung, B.⁵

2
- 0037061993
- Y. Katsumoto, T. Tanaka, H. Sato, and Y. Ozaki J. Phys. Chem. A 106 2002 3429
- (2002) J. Phys. Chem. a , vol.106 , pp. 3429
- Katsumoto, Y.¹ Tanaka, T.² Sato, H.³ Ozaki, Y.⁴

3
- 0037039278
- L. Del Freo, F. Terenziani, and A. Painelei J. Chem. Phys. 116 2002 755
- (2002) J. Chem. Phys. , vol.116 , pp. 755
- Del Freo, L.¹ Terenziani, F.² Painelei, A.³

4
- 24344452960
- A. Carvalho, R. Jones, J. Coutinho, and R.R. Briddon J. Phys.: Condens. Matter 17 2005 L155
- (2005) J. Phys.: Condens. Matter , vol.17 , pp. 155
- Carvalho, A.¹ Jones, R.² Coutinho, J.³ Briddon, R.R.⁴

5
- 14844359395
- M. Kurt, and S. Yurdakul J. Mol. Struct. 717 2005 171
- (2005) J. Mol. Struct. , vol.717 , pp. 171
- Kurt, M.¹ Yurdakul, S.²

6
- 1442326155
- D.G. Allis, H. Prinzbach, and B.S. Hudson Chem. Phys. Lett 386 2004 356
- (2004) Chem. Phys. Lett , vol.386 , pp. 356
- Allis, D.G.¹ Prinzbach, H.² Hudson, B.S.³

7
- 18144390835
- B.S. Hudson, D.G. Allis, S.F. Parker, A.J. Ramirez-Cuesta, H. Herman, and H. Prinzbach J. Phys. Chem. A 109 2005 3418
- (2005) J. Phys. Chem. a , vol.109 , pp. 3418
- Hudson, B.S.¹ Allis, D.G.² Parker, S.F.³ Ramirez-Cuesta, A.J.⁴ Herman, H.⁵ Prinzbach, H.⁶

8
- 0034664480
- T. Yildrim, S. Ciraci, C. Kilic, and A. Buldum Phys. Rev. B 62 2000 7625
- (2000) Phys. Rev. B , vol.62 , pp. 7625
- Yildrim, T.¹ Ciraci, S.² Kilic, C.³ Buldum, A.⁴

9
- 0035963815
- Y.A. Gruzdkov, and Y.M. Gupta J. Phys. Chem. A 105 2001 6197
- (2001) J. Phys. Chem. a , vol.105 , pp. 6197
- Gruzdkov, Y.A.¹ Gupta, Y.M.²

10
- 0035828005
- G.J. Kearley, M.R. Johnson, M. Plazanet, and E. Suard J. Chem. Phys. 115 2001 2614
- (2001) J. Chem. Phys. , vol.115 , pp. 2614
- Kearley, G.J.¹ Johnson, M.R.² Plazanet, M.³ Suard, E.⁴

11
- 0035933990
- A.M. Pivovar, M.D. Ward, T. Yildrim, and D.A. Neumann J. Chem. Phys. 115 2001 1909
- (2001) J. Chem. Phys. , vol.115 , pp. 1909
- Pivovar, A.M.¹ Ward, M.D.² Yildrim, T.³ Neumann, D.A.⁴

12
- 2342607028
- S.F. Parker, R. Jeans, and R. Devonshire Vib. Spectrosc 35 2004 173
- (2004) Vib. Spectrosc , vol.35 , pp. 173
- Parker, S.F.¹ Jeans, R.² Devonshire, R.³

13
- 0037191769
- S.E. Lappi, W. Collier, and S. Franzen J. Phys. Chem. A 106 2002 11446
- (2002) J. Phys. Chem. a , vol.106 , pp. 11446
- Lappi, S.E.¹ Collier, W.² Franzen, S.³

14
- 0000860283
- J. Kortus, M.R. Pederson, and S.L. Richardson Chem. Phys. Lett. 322 2000 224
- (2000) Chem. Phys. Lett. , vol.322 , pp. 224
- Kortus, J.¹ Pederson, M.R.² Richardson, S.L.³

15
- 33947459828
- R.S. Mulliken J. Am. Chem. Soc. 72 1950 600
- (1950) J. Am. Chem. Soc. , vol.72 , pp. 600
- Mulliken, R.S.¹

16
- 33947448345
- R.S. Mulliken J. Am. Chem. Soc. 74 1952 811
- (1952) J. Am. Chem. Soc. , vol.74 , pp. 811
- Mulliken, R.S.¹

17
- 0009574931
- R.S. Mulliken J. Phys. Chem. 56 1982 801
- (1982) J. Phys. Chem. , vol.56 , pp. 801
- Mulliken, R.S.¹

18
- 0003573993
- Plenum Press London
- J. Yarwood Spectroscopy and Structure of Molecular Complexes 1973 Plenum Press London
- (1973) Spectroscopy and Structure of Molecular Complexes
- Yarwood, J.¹

19
- 18844452616
- see K. Yamamoto, Md. H. Kabit, M. Hayashi, and K. Tominaga Phys. Chem. Chem. Phys. 7 2005 1945 references contained therein
- (2005) Phys. Chem. Chem. Phys. , vol.7 , pp. 1945
- Yamamoto, K.¹ Kabit Md., H.² Hayashi, M.³ Tominaga, K.⁴

20
- 0000189946
- E. Maverick, K.N. Trueblood, and D.A. Bekoe Acta Cryst. B34 1978 2777
- (1978) Acta Cryst. , vol.34 , pp. 2777
- Maverick, E.¹ Trueblood, K.N.² Bekoe, D.A.³

21
- 0001562561
- J.L. McHale, and M.J. Merriam J. Phys. Chem. 93 1989 526
- (1989) J. Phys. Chem. , vol.93 , pp. 526
- McHale, J.L.¹ Merriam, M.J.²

22
- 0000743157
- M.L. Smith, and J.L. McHale J. Phys. Chem. 89 1985 4002
- (1985) J. Phys. Chem. , vol.89 , pp. 4002
- Smith, M.L.¹ McHale, J.L.²

23
- 0000181886
- F. Markel, N.S. Ferris, I.R. Gould, and A.B. Meyrs J. Am. Chem. Soc. 114 1992 6208
- (1992) J. Am. Chem. Soc. , vol.114 , pp. 6208
- Markel, F.¹ Ferris, N.S.² Gould, I.R.³ Meyrs, A.B.⁴

24
- 0001365073
- J. Stanley, D. Smith, B. Latimer, and J.P. Devlin J. Phys. Chem. 70 1966 2011
- (1966) J. Phys. Chem. , vol.70 , pp. 2011
- Stanley, J.¹ Smith, D.² Latimer, B.³ Devlin, J.P.⁴

25
- 0000559270
- M.J. Merriam, R. Rodriguez, and J.L. McHale J. Phys. Chem. 91 1987 1058
- (1987) J. Phys. Chem. , vol.91 , pp. 1058
- Merriam, M.J.¹ Rodriguez, R.² McHale, J.L.³

26
- 0001170326
- M. Hayashi, T.-S. Yang, J. Yu, A. Mebel, S.H. Lin, I.V. Rubtsov, and K. Yoshihara J. Phys. Chem. A 102 1998 4256
- (1998) J. Phys. Chem. a , vol.102 , pp. 4256
- Hayashi, M.¹ Yang, T.-S.² Yu, J.³ Mebel, A.⁴ Lin, S.H.⁵ Rubtsov, I.V.⁶ Yoshihara, K.⁷

27
- 0000009723
- M. Hayashi, T.-S. Yang, J. Yu, A. Mebel, and S.H. Lin J. Phys. Chem. A 101 1997 4156
- (1997) J. Phys. Chem. a , vol.101 , pp. 4156
- Hayashi, M.¹ Yang, T.-S.² Yu, J.³ Mebel, A.⁴ Lin, S.H.⁵

28
- 0037446947
- M.-S. Liao, Y. Lu, and S. Scheiner J. Comput. Chem. 24 2003 623
- (2003) J. Comput. Chem. , vol.24 , pp. 623
- Liao, M.-S.¹ Lu, Y.² Scheiner, S.³

29
- 0000812956
- R. Caciuffo, A.D. Esposti, M.S. Deleuze, D.A. Leigh, A. Murphy, B. Paci, S.F. Parker, and F. Zerbetto J. Chem. Phys. 109 1998 11094
- (1998) J. Chem. Phys. , vol.109 , pp. 11094
- Caciuffo, R.¹ Esposti, A.D.² Deleuze, M.S.³ Leigh, D.A.⁴ Murphy, A.⁵ Paci, B.⁶ Parker, S.F.⁷ Zerbetto, F.⁸

30
- 13444249604
- J.A. Ciezak, and S.F. Trevino Chem. Phys. Lett. 403 2005 329
- (2005) Chem. Phys. Lett. , vol.403 , pp. 329
- Ciezak, J.A.¹ Trevino, S.F.²

31
- 0038353930
- M.R. Johnson, K. Parkinski, and I. Natkaniec Chem. Phys. 291 2003 53
- (2003) Chem. Phys. , vol.291 , pp. 53
- Johnson, M.R.¹ Parkinski, K.² Natkaniec, I.³

32
- 0141563393
- A. Pawlukojc, I. Natkaniec, G. Bator, L. Sobczyk, and E. Grech Chem. Phys. Lett. 378 2003 665
- (2003) Chem. Phys. Lett. , vol.378 , pp. 665
- Pawlukojc, A.¹ Natkaniec, I.² Bator, G.³ Sobczyk, L.⁴ Grech, E.⁵

33
- 0035953956
- B.S. Hudson J. Phys. Chem. A 105 2001 3949
- (2001) J. Phys. Chem. a , vol.105 , pp. 3949
- Hudson, B.S.¹

34
- 0002969216
- S.F. Parker, C.J. Carlile, T. Pike, J. Tomkinson, R.J. Newport, C. Andreani, F.P. Ricci, F. Sachetti, and M. Zoppi Physica B 241-242 1998 154
- (1998) Physica B , vol.241-242 , pp. 154
- Parker, S.F.¹ Carlile, C.J.² Pike, T.³ Tomkinson, J.⁴ Newport, R.J.⁵ Andreani, C.⁶ Ricci, F.P.⁷ Sachetti, F.⁸ Zoppi, M.⁹

35
- 0033884879
- Z.A. Bowden, M. Celli, F. Cilloco, D. Colognesi, R.J. Newport, S.F. Parker, R.P. Ricci, V. Rossi-Albertini, F. Sacchetti, J. Tomkinson, and M. Zoppi Physica B 276-278 2000 98
- (2000) Physica B , vol.276-278 , pp. 98
- Bowden, Z.A.¹ Celli, M.² Cilloco, F.³ Colognesi, D.⁴ Newport, R.J.⁵ Parker, S.F.⁶ Ricci, R.P.⁷ Rossi-Albertini, V.⁸ Sacchetti, F.⁹ Tomkinson, J.¹⁰ Zoppi, M.¹¹

36
- 29044442053
- M. Celli, F. Cilloco, D. Colognesi, R.J. Newport, S.F. Parker, V. Rossi-Albertini, F. Sacchetti, J. Tomkinson, and M. Zoppi Notiziaro Neutrone e Luce di Synchrotrone 6 2001
- (2001) Notiziaro Neutrone e Luce di Synchrotrone , vol.6
- Celli, M.¹ Cilloco, F.² Colognesi, D.³ Newport, R.J.⁴ Parker, S.F.⁵ Rossi-Albertini, V.⁶ Sacchetti, F.⁷ Tomkinson, J.⁸ Zoppi, M.⁹

37
- 0043049887
- A.D. Becke J. Chem. Phys. 88 1988 2547
- (1988) J. Chem. Phys. , vol.88 , pp. 2547
- Becke, A.D.¹

38
- 0034319689
- B. Delley J. Chem. Phys. 113 2003 7756
- (2003) J. Chem. Phys. , vol.113 , pp. 7756
- Delley, B.¹

39
- 34447260582
- B. Delley J. Chem. Phys. 92 1992 508
- (1992) J. Chem. Phys. , vol.92 , pp. 508
- Delley, B.¹

40
- 0000189651
- A.D. Becke J. Chem. Phys. 98 1993 5648
- (1993) J. Chem. Phys. , vol.98 , pp. 5648
- Becke, A.D.¹

41
- 0004133516
- Gaussian, Inc. Pittsburgh, PA
- Frisch M.J. et al., gaussian 98 (Revision A7), Gaussian, Inc. Pittsburgh, PA 2001.
- (2001) Gaussian 98 (Revision A7)
- Frisch, M.J.¹

42
- 1042277310
- A.J. Ramirez-Cuesta Comp. Phys. Comm. 157 2004 226
- (2004) Comp. Phys. Comm. , vol.157 , pp. 226
- Ramirez-Cuesta, A.J.¹

* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.