SCOPUS 정보 검색 플랫폼

International Journal of Quantum Chemistry

Volumn 43, Issue 1, 1992, Pages 91-118

The calculation of frequency‐dependent hyperpolarizabilities including electron correlation effects

(2) Rice, Julia E a Handy, Nicholas C b

a IBM ALMADEN RESEARCH CENTER (United States)

b UNIVERSITY OF CAMBRIDGE (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 84990675442 PISSN: 00207608 EISSN: 1097461X Source Type: Journal
DOI: 10.1002/qua.560430110 Document Type: Article

Times cited : (131)

References (41)

1
- 36449003080
- (1991) J. Chem. Phys. , vol.94 , pp. 4959
- Rice, J.E.¹ Handy, N.C.²

2
- 84951254209
- (1965) J. Chem. Phys. , vol.43 , pp. 1831
- Hayes, E.F.¹ Parr, R.G.²

3
- 24544460292
- (1973) Phys. Rev. A , vol.7 , pp. 376
- Klingbeil, R.¹

4
- 49249144817
- (1979) Chem. Phys. Lett. , vol.61 , pp. 473
- Santry, D.P.¹ Raidy, T.E.²

5
- 36549102995
- (1986) J. Chem. Phys. , vol.85 , pp. 976
- Sekino, H.¹ Bartlett, R.J.²

6
- 36549092205
- (1990) J. Chem. Phys. , vol.93 , pp. 8828
- Rice, J.E.¹ Amos, R.D.² Colwell, S.M.³ Handy, N.C.⁴ Sanz, J.⁵

7
- 25344467375
- (1990) Chem. Phys. Lett. , vol.171 , pp. 201
- Karna, S.¹ Dupuis, M.²

8
- 36549097845
- Hyperpolarizabilities of the hydrogen fluoride molecule: A discrepancy between theory and experiment?
- (1986) The Journal of Chemical Physics , vol.84 , pp. 2726
- Sekino, H.¹ Bartlett, R.J.²

9
- 0000501950
- (1979) Phys. Rev. A , vol.20 , pp. 1313
- Bartlett, R.J.¹ Purvis, G.D.²

10
- 0000069011
- (1990) J. Chem. Phys. , vol.93 , pp. 652
- Maroulis, G.¹ Thakkar, A.J.²

11
- 0010027017
- (1989) Chem. Phys. Lett. , vol.163 , pp. 359
- Taylor, P.R.¹ Lee, T.J.² Rice, J.E.³ Almlöf, J.⁴

12
- 84990713394
- Chem. Phys. Lett.

13
- 0004894243
- (1989) Chem. Phys. Lett. , vol.156 , pp. 87
- Maroulis, G.¹ Thakkar, A.J.²

14
- 0001585330
- (1991) J. Chem. Phys. , vol.94 , pp. 4972
- Rice, J.E.¹ Taylor, P.R.² Lee, T.J.³ Almlöf, J.⁴

15
- 36449005616
- (1991) J. Chem. Phys. , vol.94 , pp. 1182
- Maroulis, G.¹

16
- 5244347521
- (1981) Phys. Rev. A , vol.23 , pp. 1594
- Purvis, G.D.¹ Bartlett, R.J.²

17
- 48549108996
- (1984) Comp. Phys. Rep. , vol.2 , pp. 33
- Oddershede, J.¹ Jorgensen, P.² Yeager, D.L.³

18
- 0001232234
- (1982) Chem. Phys. , vol.64 , pp. 359
- Oddershede, J.¹ Svendsen, E.N.²

19
- 0002953560
- (1972) Chem. Phys. Lett. , vol.14 , pp. 1
- Löwdin, P.‐O.¹ Mukherjee, P.K.²

20
- 0004008602
- Oxford University Press [Clarendon], London and New York
- (1934) Wave Mechanics, Advanced General Theory , pp. 436
- Frenkel, J.¹

21
- 11644259152
- (1987) Chem. Phys. , vol.114 , pp. 9
- Simandiras, E.D.¹ Amos, R.D.² Handy, N.C.³

22
- 36549092414
- (1984) J. Chem. Phys. , vol.81 , pp. 5031
- Handy, N.C.¹ Schaefer, H.F.²

23
- 84990650196
- IBM Publication RJ945
- (1971)
- van Duijneveldt, F.B.¹

24
- 33748497962
- (1987) J. Chem. Phys. , vol.86 , pp. 4070
- Almlöf, J.¹ Taylor, P.R.²

25
- 0002613305
- (1971) J. Mol. Spectr. , vol.38 , pp. 70
- Yamada, K.¹ Nakagawa, T.² Kuchitsu, K.³ Morino, Y.⁴

26
- 0001325680
- VIBRATION–ROTATION BANDS OF AMMONIA: II. THE MOLECULAR DIMENSIONS AND HARMONIC FREQUENCIES OF AMMONIA AND DEUTERATED AMMONIA
- (1957) Canadian Journal of Physics , vol.35 , pp. 1235
- Benedict, W.S.¹ Plyler, K.²

27
- 0003990718
- Cambridge University, Cambridge, England
- (1987) CADPAC: Cambridge Analytic Derivatives Package, Issue 4
- Amos, R.D.¹ Rice, J.E.²

28
- 84990641656
- MOLECULE 3 is a vectorized integral code written by
- Almlöf, J.¹ Taylor, P.R.²

29
- 0003588968
- Van Nostrand, New York
- (1966) Electronic Spectra and Electronic Structure of Polyatomic Molecules
- Herzberg, G.¹

30
- 0000001135
- (1990) Phys. Rev. A , vol.42 , pp. 2578
- Shelton, D.P.¹

31
- 36449008791
- (1991) J. Chem. Phys. , vol.95 , pp. 5489
- Bishop, D.M.¹

32
- 36549098695
- (1989) J. Chem. Phys. , vol.90 , pp. 3192
- Bishop, D.M.¹

33
- 0010380429
- (1986) J. Chem. Phys. , vol.85 , pp. 2077
- Liu, S.‐Y.¹ Dykstra, C.E.² Kolenbrander, K.³ Lisy, J.M.⁴

34
- 0000899151
- (1981) J. Chem. Phys. , vol.74 , pp. 5216
- Lazzeretti, P.¹ Zanasi, R.²

35
- 84990695633
- Rice, J.E.¹

36
- 0000603599
- (1979) Phys. Rev. A , vol.19 , pp. 826
- Ward, J.F.¹ Miller, C.K.²

37
- 0043231303
- (1990) Rev. Mod. Phys. , vol.62 , pp. 343
- Bishop, D.M.¹

38
- 0001371538
- (1986) J. Chem. Phys. , vol.84 , pp. 4988
- Adamowicz, L.¹ Bartlett, R.J.²

39
- 36549094284
- Erratum: Numerical coupled Hartree–Fock study of the total (electronic and nuclear) parallel polarizability and hyperpolarizability for the FH, H+2, HD+, and D2 molecules [J. Chem. Phys. 84, 4988 (1986)]
- (1987) The Journal of Chemical Physics , vol.86 , pp. 7250
- Adamowicz, L.¹ Bartlett, R.J.²

40
- 0001126914
- (1989) Chem. Phys. Lett. , vol.164 , pp. 185
- Handy, N.C.¹ Pople, J.A.² Head‐Gordon, M.³ Raghavachari, K.⁴ Trucks, G.W.⁵

41
- 0001013051
- (1990) Chem. Phys. Lett. , vol.167 , pp. 115
- Pople, J.A.¹ Replogle, E.S.² Head‐Gordon, M.³ Handy, N.C.⁴

* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.