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Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy

Volumn 57, Issue 4, 2001, Pages 875-885

A fully ab initio potential curve of near-spectroscopic quality for OH- ion: Importance of connected quadruple excitations and scalar relativistic effects

(1) Martin, Jan M L a

a WEIZMANN INSTITUTE OF SCIENCE (Israel)

Author keywords

Interstellar medium; Molecular anions; Nondynamical correlation; Relativistic effects; Spectroscopic constants

Indexed keywords

DISSOCIATION; ELECTRIC EXCITATION; HYDROGEN INORGANIC COMPOUNDS; MOLECULAR DYNAMICS;

HYDROXIDE;

NEGATIVE IONS;

HYDROXIDE; HYDROXIDE ION;

ARTICLE; ASTRONOMY; CALIBRATION; CHEMICAL MODEL; CHEMISTRY; DIAGNOSIS, MEASUREMENT AND ANALYSIS;

ASTRONOMY; CALIBRATION; COSMIC DUST; HYDROXIDES; LABORATORY TECHNIQUES AND PROCEDURES; MODELS, CHEMICAL;

EID: 0035866537 PISSN: 13861425 EISSN: None Source Type: Journal
DOI: 10.1016/S1386-1425(00)00450-9 Document Type: Article

Times cited : (22)

References (63)

1
- 0001435160
- (1978) Astrophys. J. , vol.220 , pp. 124
- Duley, W.W.¹ Millar, T.J.²

2
- 33747452062
- (1996) Astron. Astrophys., Suppl. Ser. , vol.119 , pp. 111
- Lee, H.-H.¹ Bettens, R.P.A.² Herbst, E.³

3
- 4244045461
- (1980) Chem. Phys. Lett. , vol.73 , pp. 616
- Vardya, M.S.¹ Krishnaswamy, K.S.²

4
- 0000041671
- (1982) Astron. Astrophys. , vol.105 , pp. 219
- Wallerstein, G.¹

5
- 36549092541
- (1988) J. Chem. Phys. , vol.89 , pp. 129
- Rehfuss, B.D.¹ Liu, D.-J.² Dinelli, B.M.³ Jagod, M.-F.⁴ Ho, W.C.⁵ Crofton, M.W.⁶ Oka, T.⁷

6
- 0004240372
- Clarendon Press, Oxford
- (1991) Chemistry of Atmospheres, 2nd edn.
- Wayne, R.P.¹

7
- 0000667168
- (1999) Spectrochimica Acta , vol.A55 , pp. 739
- Lee, T.J.¹ Dateo, C.E.²

8
- 0002935533
- C.B. Cosmovici, S. Bowyer, D. Wertheimer (Eds.), Editrice Compositori, Bologna
- (1997) Astronomical and Biochemical Origins and the Search for Life in the Universe , pp. 23-47
- Allamandola, L.¹ Bernstein, M.P.² Sanford, S.A.³

9
- 0003919080
- Van Nostrand Reinhold, New York
- (1979) Constants of Diatomic Molecules
- Huber, K.P.¹ Herzberg, G.²

10
- 0005488774
- (1994) J. Phys. Chem. Ref. Data Monograph , vol.3
- Jacox, M.E.¹

11
- 0043211189
- (1998) J. Phys. Chem. Ref. Data , vol.27 , pp. 115
- Jacox, M.E.¹

12
- 0000640261
- (1992) Chem. Rev. , vol.92 , pp. 141
- Hirota, E.¹

13
- 0001703597
- (1988) Phil. Trans. Royal Soc. (London) , vol.A324 , pp. 163
- Amano, T.¹

14
- 26444601849
- (1988) Phil. Trans. Royal Soc. (London) , vol.A324 , pp. 97
- Owrutsky, J.¹ Rosenbaum, N.² Tack, L.³ Gruebele, M.⁴ Polak, M.⁵ Saykally, R.J.⁶

15
- 0024281163
- (1988) Science , vol.239 , pp. 157
- Saykally, R.J.¹

16
- 0006496182
- (1995) Int. Rev. Phys. Chem. , vol.14 , pp. 169
- Botschwina, P.¹ Seeger, S.² Mladenović, M.³ Schulz, B.⁴ Horn, M.⁵ Schmatz, S.⁶ Flügge, J.⁷ Oswald, R.⁸

17
- 0031386145
- (1997) J. Chem. Phys. , vol.107 , pp. 10373
- Lee, T.J.¹ Dateo, C.E.²

18
- 0000607904
- (1984) Ann. Rev. Phys. Chem. , vol.35 , pp. 387
- Gudeman, C.S.¹ Saykally, R.J.²

19
- 36549096542
- (1986) J. Chem. Phys. , vol.84 , pp. 5308
- Rosenbaum, N.H.¹ Owrutsky, J.C.² Tack, L.M.³ Saykally, R.J.⁴

20
- 36549097113
- (1985) J. Chem. Phys. , vol.83 , pp. 5338
- Owrutsky, J.C.¹ Rosenbaum, N.H.² Tack, L.M.³ Saykally, R.J.⁴

21
- 0000452236
- (1986) J. Chem. Phys. , vol.85 , pp. 1785
- Rehfuss, B.D.¹ Crofton, M.W.² Oka, T.³

22
- 36549097793
- (1986) J. Chem. Phys. , vol.84 , pp. 2426
- Liu, D.J.¹ Oka, T.²

23
- 0000605242
- (1982) J. Chem. Phys. , vol.77 , pp. 1153
- Schulz, P.A.¹ Mead, R.D.² Jones, P.L.³ Lineberger, W.C.⁴

24
- 0000974227
- (1997) Phys. Rev. A , vol.55 , pp. 2036
- Smith, J.R.¹ Kim, J.B.² Lineberger, W.C.³

25
- 0000294697
- (1983) J. Chem. Phys. , vol.79 , pp. 905
- Werner, H.-J.¹ Rosmus, P.² Reinsch, E.-A.³

26
- 0000122016
- (1982) J. Chem. Phys. , vol.76 , pp. 1910
- Purvis III, G.D.¹ Bartlett, R.J.²

27
- 0006244148
- (1989) Chem. Phys. Lett. , vol.157 , pp. 479
- Raghavachari, K.¹ Trucks, G.W.² Pople, J.A.³ Head-Gordon, M.⁴

28
- 0001106715
- (1998) J. Chem. Phys. , vol.108 , pp. 676
- Martin, J.M.L.¹ Lee, T.J.² Taylor, P.R.³

29
- 0000885143
- (1998) J. Chem. Phys. , vol.108 , pp. 2791
- Martin, J.M.L.¹

30
- 0000532817
- (1998) Chem. Phys. Lett. , vol.292 , pp. 411
- Martin, J.M.L.¹

31
- 0344628184
- (1988) Chem. Phys. Lett. , vol.143 , pp. 413
- Gdanitz, R.J.¹ Ahlrichs, R.²

33
- 36549092221
- 89 (1988) 3401 (Erratum)
- (1987) J. Chem. Phys. , vol.86 , pp. 7041
- Noga, J.¹ Bartlett, R.J.²

34
- 24544463432
- (1989) Chem. Phys. Lett. , vol.158 , pp. 550
- Kucharski, S.A.¹ Bartlett, R.J.²

35
- 0344980861
- (1990) J. Phys. Chem. , vol.94 , pp. 5579
- Raghavachari, K.¹ Pople, J.A.² Replogle, E.S.³ Head-Gordon, M.⁴

36
- 0005436424
- ACES II, an ab initio program system, incorporating the MOLECULE vectorized molecular integral program by J. Almlöf P.R. Taylor, and a modified version of the ABACUS integral derivative package by T. Helgaker, H.J. Aa. Jensen, P. Jørgensen, J. Olsen, P.R. Taylor
- (1996)
- Stanton, J.F.¹ Gauss, J.² Watts, J.D.³ Lauderdale, W.⁴ Bartlett, R.J.⁵

37
- 33746614482
- (1989) J. Chem. Phys. , vol.90 , pp. 1007
- Dunning T.H., Jr.¹

38
- 0002189364
- Correlation consistent basis sets for molecular calculations
- P. von Ragué Schleyer (Ed.), Wiley & Sons, Chichester
- (1998) Encyclopedia of Computational Chemistry
- Dunning T.H., Jr.¹ Peterson, K.A.² Woon, D.E.³

39
- 4143095330
- (1992) J. Chem. Phys. , vol.96 , pp. 6796
- Kendall, R.A.¹ Dunning, T.H.² Harrison, R.J.³

40
- 33645611213
- (1993) J. Phys. Chem. , vol.97 , pp. 107
- Del Bene, J.E.¹

41
- 36449006587
- (1995) J. Chem. Phys. , vol.103 , pp. 4572
- Woon, D.E.¹ Dunning T.H., Jr.²

42
- 3343000028
- (1993) Chem. Phys. Lett. , vol.214 , pp. 481
- Szalay, P.G.¹ Bartlett, R.J.²

43
- 0017009718
- (1976) J. Opt. Soc. Am. , vol.66 , pp. 1010
- Cowan, R.D.¹ Griffin, M.²

44
- 0346879006
- (1983) J. Phys. Chem. , vol.87 , pp. 750
- Martin, R.L.¹

45
- 4243307847
- (1932) Phys. Rev. , vol.41 , pp. 721
- Dunham, J.L.¹

46
- 0003374599
- 2 term was originally proposed (under the name 'generalized Morse function') by P.J. Kuntz A.C. Roach, J. Chem. Soc. Faraday Trans. II 68 (1972) 259
- (1992) J. Mol. Spectrosc. , vol.152 , pp. 274
- Coxon, J.A.¹

47
- 0020787282
- CPC library program ACET
- (1983) Comput. Phys. Commun. , vol.30 , pp. 101
- Ogilvie, J.F.¹

48
- 0026401726
- CPC library program ABCQ
- (1991) Comput. Phys. Commun. , vol.67 , pp. 285
- Balint-Kurti, G.G.¹ Ward, C.L.² Marston, C.C.³

49
- 45149135930
- (1990) Chem. Phys. Lett. , vol.165 , pp. 513
- Bartlett, R.J.¹ Watts, J.D.² Kucharski, S.A.³ Noga, J.⁴

50
- 0011146775
- (1998) J. Phys. Chem. , vol.A102 , pp. 8044
- Bauschlicher C.W., Jr.¹ Ricca, A.²

51
- 0001750657
- (1999) J. Chem. Phys. , vol.111 , pp. 1843
- Martin, J.M.L.¹ De Oliveira, G.²

52
- 0000530938
- (1999) J. Phys. Chem. , vol.A103 , pp. 7715
- Bauschlicher C.W., Jr.¹ Martin, J.M.L.² Taylor, P.R.³

53
- 0038683810
- erratum 312, (1999), 613
- (1998) Chem. Phys. Lett. , vol.293 , pp. 317
- Csaszar, A.G.¹ Kain, J.S.² Polyansky, O.L.³ Zobov, N.F.⁴ Tennyson, J.⁵

54
- 0001627784
- (2000) J. Phys. Chem. , vol.A104 , pp. 2281
- Bauschlicher C.W., Jr.¹

55
- 36148931496
- (1974) Ann. Phys. (NY) , vol.82 , pp. 89
- Douglas, M.¹ Kroll, N.M.²

56
- 36449004790
- references therein
- (1992) J. Chem. Phys. , vol.96 , pp. 1227
- Samzow, R.¹ Hess, B.A.² Jansen, G.³

57
- 0033423510
- (1999) Theor. Chem. Acc. , vol.101 , pp. 421
- Bauschlicher C.W., Jr.¹

58
- 0347007668
- (1992) J. Chem. Phys. , vol.96 , pp. 6104
- Feller, D.¹

59
- 0032502389
- (1998) Chem. Phys. Lett. , vol.286 , pp. 243
- Halkier, A.¹ Helgaker, T.² Jøgensen, P.³ Klopper, W.⁴ Koch, H.⁵ Olsen, J.⁶ Wilson, A.K.⁷

60
- 0001536458
- Atomic energy levels
- (1949) Natl. Bur. Stand. (US) Circ. , pp. 467
- Moore, C.E.¹

61
- 0000592747
- A recent review proposes a minor revision to 1.4611107(17) eV: C. Blondel, Phys. Scr. T58 (1995) 31
- (1985) Phys. Rev. , vol.A32 , pp. 1890
- Neumark, D.M.¹ Lykke, K.R.² Andersen, T.³ Lineberger, W.C.⁴

62
- 0001210423
- (1999) Phys. Rev. , vol.A60 , pp. 1034
- De Oliveira, G.¹ Martin, J.M.L.² De Proft, F.³ Geerlings, P.⁴

63
- 0031564809
- (1997) Chem. Phys. Lett. , vol.273 , pp. 98
- Martin, J.M.L.¹

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