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Journal of Molecular Structure: THEOCHEM

Volumn 594, Issue 1-2, 2002, Pages 79-88

A density functional theory analysis of Raman and IR spectra of 2-adamantanone

(3) Bistričić, Lahorija a Pejov, Ljupčo b Baranović, Goran c

a UNIVERSITY OF ZAGREB (Croatia)

b SS CYRIL AND METHODIUS UNIVERSITY (Macedonia)

c RUDER BO KOVI INSTITUTE (Croatia)

Author keywords

2 Adamantanone; Adamantane; Density functional theory; IR and Raman intensities

Indexed keywords

2 ADAMANTANONE DERIVATIVE; ADAMANTANE; CARBENE; HYDROGEN;

ARTICLE; CALCULATION; DENSITY; GEOMETRY; INFRARED SPECTROSCOPY; RAMAN SPECTROMETRY; RATING SCALE; THEORETICAL STUDY; VIBRATION;

EID: 0037063784 PISSN: 01661280 EISSN: None Source Type: Journal
DOI: 10.1016/S0166-1280(02)00367-6 Document Type: Article

Times cited : (27)

References (28)

1
- 0003622715
- Elsevier, Amsterdam, Chapters 1-4
- (1995) Modern Density Functional Theory: A Tool for Chemistry
- Seminario, J.M.¹ Politzer, P.²

2
- 0003569570
- Oxford University Press, Oxford, Chapter 1
- (1989) Density Functional Theory of Atoms and Molecules
- Parr, R.G.¹ Yang, W.²

3
- 0042113153
- (1965) Phys. Rev. A , vol.140 , pp. 1133
- Kohn, W.¹ Sham, L.J.²

4
- 10644250257
- (1964) Phys. Rev. B , vol.136 , pp. 864
- Hohenberg, P.¹ Kohn, W.²

5
- 0000036260
- (1996) J. Phys. Chem. , vol.100 , pp. 16530
- Choi, C.H.¹ Kertesz, M.²

6
- 16444375810
- (1993) J. Chem. Phys. , vol.98 , pp. 5612
- Johnson, B.G.¹ Gill, P.M.W.² Pople, J.A.³

7
- 0011083273
- (1996) Phys. Chem. , vol.100 , pp. 16502
- Scott, A.P.¹ Radom, L.J.²

8
- 84947389765
- (1976) Mol. Phys. , vol.31 , pp. 1377
- Blom, C.E.¹ Altona, C.²

9
- 0020843873
- (1983) J. Am. Chem. Soc. , vol.105 , pp. 7037
- Pulay, P.¹ Fogarasi, G.² Pongor, G.³ Boggs, J.E.⁴ Vargha, A.⁵

10
- 30244520618
- (1997) Spectrochim. Acta A , vol.53 , pp. 1211
- Fogarasi, G.¹

11
- 0010466189
- (1996) Mol. Phys. , vol.2 , pp. 161
- Szasz, G.¹ Kovacs, A.²

12
- 0040005732
- (1998) Chem. Phys. , vol.238 , pp. 231
- Kovacs, A.¹ Izvekov, V.² Keresztury, G.³ Pongor, G.⁴

13
- 0000189651
- (1993) J. Chem. Phys. , vol.98 , pp. 5648
- Becke, A.D.¹

14
- 0345491105
- (1988) Phys. Rev. B , vol.37 , pp. 785
- Lee, C.¹ Yang, W.² Parr, R.G.³

15
- 9344269016
- (1995) J. Phys. Chem. , vol.99 , pp. 3093
- Rauhut, G.¹ Pulay, P.²

16
- 0032495375
- (1998) J. Phys. Chem. A , vol.102 , pp. 484
- Szasz, G.¹ Kovacs, A.² Hargattai, I.³ Jeon, I.⁴ Miller, G.P.⁵

17
- 0031234750
- (1997) J. Phys. Chem. A , vol.101 , pp. 7283
- Esposti, A.D.¹ Zerbetto, F.J.²

18
- 0345492192
- (1998) Spectrochim. Acta A , vol.54 , pp. 1961
- Bistričić, L.¹ Baranović, G.² Mlinarić-Majerski, K.³

19
- 0000072033
- (1995) Spectrochim. Acta A , vol.51 , pp. 1643
- Bistričić, L.¹ Baranović, G.² Mlinarić-Majerski, K.³

20

21
- 84986439201
- (1982) J. Comput. Chem. , vol.3 , pp. 214
- Schlegel, H.B.¹

22
- 4243553426
- (1988) Phys. Rev. A , vol.38 , pp. 3098
- Becke, A.D.¹

23
- 0000434282
- (1965) Acta Crystallogr. , vol.18 , pp. 764
- Nordman, C.E.¹ Schmitkons, D.L.²

24
- 0010505236
- (1996) J. Org. Chem. , vol.62 , pp. 441
- Gung, B.W.¹ Wolf, M.A.²

25
- 0001653116
- (1999) J. Chem. Phys , vol.111 , pp. 8819
- Halls, M.D.¹ Schlegel, H.B.²

26
- 0035590136
- (2001) Theor. Chem. Acc. , vol.105 , pp. 413
- Halls, M.D.¹ Velkovski, J.² Schlegel, H.B.³

27
- 0000496681
- (1998) J. Chem. Phys. , vol.109 , pp. 10587
- Halls, M.D.¹ Schlegel, H.B.²

28
- 0001347918
- (1998) J. Raman Spectrosc. , vol.29 , pp. 501
- Negri, F.¹ Orlandi, G.²

* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.