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Volumn 480-481, Issue , 1999, Pages 263-267

Structure and dynamics of conformationally non-rigid molecules in excited electronic states: Ab initio calculations of the R2CO (R = H, F, Cl)

Author keywords

Barrier to inversion; Carbonyl compounds; CASSCF; Excited states

Indexed keywords

CARBONYL DERIVATIVE; CHLORINE; FLUORINE; HYDROGEN;

CALCULATION; CONFERENCE PAPER; CONFORMATIONAL TRANSITION; DYNAMICS; EXCITATION; VIBRATION;

EID: 0033522528 PISSN: 00222860 EISSN: None Source Type: Journal
DOI: 10.1016/S0022-2860(98)00813-8 Document Type: Conference Paper

Times cited : (14)

References (13)

1
- 18644371148
- D.C. Moule, A.D. Walsh, Chem. Rev. 75 (1975) 67.
- (1975) Chem. Rev. , vol.75 , pp. 67
- Moule, D.C.¹ Walsh, A.D.²

2
- 0344346688
- D.J. Clouthier, D.A. Ramsay, Ann. Rev. Phys. Chem. 34 (1983) 58.
- (1983) Ann. Rev. Phys. Chem. , vol.34 , pp. 58
- Clouthier, D.J.¹ Ramsay, D.A.²

3
- 36749115526
- R.H. Judge, D.C. Moule, J. Chem. Phys. 78 (1983) 4806.
- (1983) J. Chem. Phys. , vol.78 , pp. 4806
- Judge, R.H.¹ Moule, D.C.²

4
- 33750477039
- D.C. Moule, R.D. Foo, J. Chem.Phys. 55 (1971) 1262.
- (1971) J. Chem.Phys. , vol.55 , pp. 1262
- Moule, D.C.¹ Foo, R.D.²

5
- 0009012802
- C.M. Hadad, J.B. Foresman, K.B. Wiberg, J. Phys. Chem. 97 (1993) 4293.
- (1993) J. Phys. Chem. , vol.97 , pp. 4293
- Hadad, C.M.¹ Foresman, J.B.² Wiberg, K.B.³

6
- 0000197003
- M. Merchan, B.O. Roos, Theor. Chim. Acta 92 (1995) 227.
- (1995) Theor. Chim. Acta , vol.92 , pp. 227
- Merchan, M.¹ Roos, B.O.²

7
- 21944452686
- T. Nakajima, S. Kato, J. Chem. Phys. 105 (1996) 5927.
- (1996) J. Chem. Phys. , vol.105 , pp. 5927
- Nakajima, T.¹ Kato, S.²

8
- 0001420090
- J.C. Francisco, Z. Li, M.R. Hand, I.H. Williams, Chem. Phys. Lett. 214 (1993) 591.
- (1993) Chem. Phys. Lett. , vol.214 , pp. 591
- Francisco, J.C.¹ Li, Z.² Hand, M.R.³ Williams, I.H.⁴

9
- 0009308263
- A. Kapur, R.P. Steer, P.G. Mezey, Can. J. Chem. 60 (1982) 100.
- (1982) Can. J. Chem. , vol.60 , pp. 100
- Kapur, A.¹ Steer, R.P.² Mezey, P.G.³

10
- 84893169025
- M.W. Schmidt, K.K. Baldridge, J.A. Boatz, S.T. Elbert, M.S. Gordon, J.J. Jensen, S. Koseki, N. Matsunaga, K.A. Nguyen, S. Su, T.L. Windus, M. Dupuis, J.A. Montgomery, J. Comput. Chem. 14 (1993) 1347.
- (1993) J. Comput. Chem. , vol.14 , pp. 1347
- Schmidt, M.W.¹ Baldridge, K.K.² Boatz, J.A.³ Elbert, S.T.⁴ Gordon, M.S.⁵ Jensen, J.J.⁶ Koseki, S.⁷ Matsunaga, N.⁸ Nguyen, K.A.⁹ Su, S.¹⁰ Windus, T.L.¹¹ Dupuis, M.¹² Montgomery, J.A.¹³

11
- 36849101490
- T. Ueda, T. Shimanouchi, J. Chem. Phys. 47 (1967) 4042.
- (1967) J. Chem. Phys. , vol.47 , pp. 4042
- Ueda, T.¹ Shimanouchi, T.²

12
- 0000703066
- J.B. Foresman, M. Head-Gordon, J.A. Pople, M.J. Frish, J. Phys. Chem. 96 (1992) 135.
- (1992) J. Phys. Chem. , vol.96 , pp. 135
- Foresman, J.B.¹ Head-Gordon, M.² Pople, J.A.³ Frish, M.J.⁴

13
- 0344778547
- in press
- I.A. Godunov, A.V. Abramenkov, N.N. Yakovlev, Russ. J. Struct. Chem. 39 (1998) (in press).
- (1998) Russ. J. Struct. Chem. , vol.39
- Godunov, I.A.¹ Abramenkov, A.V.² Yakovlev, N.N.³

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