SCOPUS 정보 검색 플랫폼

Journal of Molecular Structure: THEOCHEM

Volumn 547, Issue 1-3, 2001, Pages 239-244

State-specific Brillouin - Wigner multireference coupled cluster study of the F2 molecule: Assessment of the a posteriori size-extensivity correction

(4) Pittner, Jiří a Smydke, Jan a Ársky, Petr a Hubač, Ivan b

a J HEYROVSKÝ INSTITUTE OF PHYSICAL CHEMISTRY (Czech Republic)

b Physics and Informatics (Slovakia)

Author keywords

Brillouin Wigner perturbation theory; Intruder states; Multireference coupled clusters; Potential curve; Size extensivity; Spectroscopic constants of F2; State specific methods

Indexed keywords

ARTICLE; CLUSTER ANALYSIS; ELECTRIC POTENTIAL; MATHEMATICAL ANALYSIS; MOLECULAR DYNAMICS; SPECTROSCOPY;

EID: 0035939360 PISSN: 01661280 EISSN: None Source Type: Journal
DOI: 10.1016/S0166-1280(01)00473-0 Document Type: Article

Times cited : (43)

References (36)

1
- 36849130987
- (1961) J. Chem. Phys. , vol.34 , pp. 221
- Hijikata, K.¹

2
- 0004460681
- (1964) J. Chem. Phys. , vol.41 , pp. 2600
- Wahl, A.C.¹

3
- 0001719725
- (1974) J. Chem. Phys. , vol.60 , pp. 1288
- Lie, G.C.¹ Clementi, E.²

4
- 0002686501
- (1966) J. Chem. Phys. , vol.44 , pp. 87
- Das, G.¹ Wahl, A.C.²

5
- 36549095109
- (1987) J. Chem. Phys. , vol.86 , pp. 887
- Laidig, W.D.¹ Saxe, P.² Bartlett, R.J.³

6
- 0001586951
- (1979) J. Chem. Phys. , vol.70 , pp. 3191
- Cartwright, D.C.¹ Hay, P.J.²

7
- 0001651883
- (1981) J. Chem. Phys. , vol.74 , pp. 4566
- Jonsson, B.¹ Roos, B.O.² Taylor, P.R.³ Siegbahn, P.E.M.⁴

8
- 0004483458
- (2000) Int. J. Quantum Chem. , vol.76 , pp. 185
- Sychrovský, V.¹ Čársky, P.² Lischka, H.³

9
- 0004463644
- (1987) Chem. Phys. , vol.115 , pp. 405
- Rama Krishna, M.V.¹ Jordan, K.D.²

10
- 0000081711
- (1987) Chem. Phys. Lett. , vol.135 , pp. 543
- Langhoff, S.R.¹ Bauschlicher C.W., Jr.² Taylor, P.R.³

11
- 36549093927
- (1985) J. Chem. Phys. , vol.82 , pp. 1413
- Jankowski, K.¹ Becherer, R.² Scharf, P.³ Schiffer, H.⁴ Ahlrichs, R.⁵

12
- 0002280353
- (1981) Chem. Phys. Lett. , vol.81 , pp. 4
- Blomberg, M.R.A.¹ Siegbahn, P.E.M.²

13
- 0000060827
- (1985) Chem. Phys. , vol.98 , pp. 381
- Ahlrichs, R.¹ Scharf, P.² Jankowski, K.³

14
- 0004483459
- (1983) Int. J. Quantum Chem. , vol.17 S , pp. 331
- Frisch, M.J.¹ Binkley, J.S.²

15
- 36549101130
- (1985) J. Chem. Phys. , vol.82 , pp. 4607
- Raghavachari, K.¹

16
- 0002745201
- (1992) Chem. Phys. Lett. , vol.190 , pp. 1
- Hampel, C.¹ Peterson, K.A.² Werner, H.J.³

17
- 0031285836
- (1997) Theor. Chem. Acc. , vol.97 , pp. 251
- Peterson, K.A.¹ Wilson, A.K.² Woon, D.E.³ Dunning T.H., Jr.⁴

18
- 0001739899
- (1991) J. Chem. Phys. , vol.95 , pp. 6652
- Watts, J.D.¹ Bartlett, R.J.²

19
- 0001351416
- (1995) Theor. Chim. Acta , vol.92 , pp. 241
- Sanchez-Marin, J.¹ Nebot-Gil, I.² Maynau, D.³ Malrieu, J.P.⁴

20
- 0031565077
- (1997) Theor. Chem. Acc. , vol.98 , pp. 165
- Tanaka, K.¹ Mochizuki, Y.²

21
- 0000043104
- (2000) Chem. Phys. Lett. , vol.317 , pp. 472
- Angeli, C.¹ Cimiraglia, R.² Malrieu, J.P.³

22
- 0000561826
- (1993) J. Chem. Phys. , vol.99 , pp. 9790
- Peterson, K.A.¹ Kendall, R.A.² Dunning T.H., Jr.³

23
- 0003919078
- Van Nostrand Reinhold, New York
- (1979) Molecular Spectra and Molecular Structure. IV. Constants of Diatomic Molecules
- Huber, K.P.¹ Herzberg, G.²

24
- 21544470104
- (1990) Theor. Chim. Acta , vol.78 , pp. 175
- Werner, H.J.¹ Knowles, P.J.²

25
- 0012021002
- (1998) J. Chem. Phys. , vol.108 , pp. 637
- Li, X.¹ Paldus, J.²

26
- 0001646967
- (1998) J. Chem. Phys. , vol.108 , pp. 6571
- Mášik, J.¹ Hubač, I.² Mach, P.³

27
- 0002305516
- R. McWeeny, J. Maruani, Y.G. Smeyers, S. Wilson (Eds.), Kluwer Academic Publishers, Dordrecht
- (1997) Quantum Systems in Chemistry and Physics: Trends in Methods and Applications , pp. 282-308
- Mášik, J.¹ Hubač, I.²

28
- 0002669436
- A. Tsipis, D.R. Herschbach, V.S. Popov, J.S. Avery (Eds.), NATO ASI, Kluwer Academic Publishers, Dordrecht
- (1996) New Methods in Quantum Theory , pp. 183-202
- Hubač, I.¹

29
- 0001832427
- (1999) Advan. Quantum Chem. , vol.31 , pp. 75
- Mášik, J.¹ Hubač, I.²

30
- 0033888659
- (2000) J. Phys. B , vol.33 , pp. 365
- Hubač, I.¹ Wilson, S.²

31
- 0001733067
- (2000) J. Chem. Phys. , vol.112 , pp. 8779
- Hubač, I.¹ Pittner, J.² Čársky, P.³

32
- 0000401068
- (1999) J. Chem. Phys. , vol.110 , pp. 10275
- Pittner, J.¹ Nachtigall, P.² Čársky, P.³ Mášik, J.⁴ Hubač, I.⁵

33
- 0004512901
- Integral packages included are VMOL (J. Almloef and P. R. Taylor); VPROPS (P. R. Taylor); and ABACUS (T. Helgaker, H.J. Aa. Jensen, P. Joergensen, J. Olsen., P.R. Taylor); (ACES II is a program product of Quantum Theory Project, University of Florida)
- Stanton, J.F.¹ Gauss, J.² Watts, J.D.³ Nooijen, M.⁴ Oliphant, N.⁵ Perera, S.A.⁶ Szalay, P.G.⁷ Lauderdale, W.J.⁸ Gwaltney, S.R.⁹ Beck, S.¹⁰ Balkova, A.¹¹ Bernholdt, D.E.¹² Baeck, K.-K.¹³ Rozyczko, P.¹⁴ Sekino, H.¹⁵ Huber, C.¹⁶ Bartlett, R.J.¹⁷

34
- 0001750657
- (1999) J. Chem. Phys. , vol.111 , pp. 1843
- Martin, J.M.L.¹ De Oliveira, G.²

35
- 36449000993
- (1992) J. Chem. Phys. , vol.97 , pp. 5012
- Martin, J.M.L.¹

36
- 0034269419
- (2000) J. Chem. Phys. , vol.113 , pp. 4549
- Nooijen, M.¹ Lotrich, V.²

* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.