SCOPUS 정보 검색 플랫폼

Volumn 116, Issue 3, 2002, Pages 869-877

Shielding polarizabilities calculated at the coupled-cluster singles and doubles level augmented by a perturbative treatment of triple excitations

(2) Rizzo, Antonio a Gauss, Jürgen b

a CNR (Italy)

b JOHANNES GUTENBERG UNIVERSITY (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

CORRELATION METHODS; ELECTRIC FIELD EFFECTS; FINITE DIFFERENCE METHOD; NUCLEAR MAGNETIC RESONANCE; PERTURBATION TECHNIQUES; POLARIZATION; RADIATION SHIELDING;

NUCLEAR MAGNETIC SHIELDING;

MAGNETIC SHIELDING;

EID: 0037080911 PISSN: 00219606 EISSN: None Source Type: Journal
DOI: 10.1063/1.1425405 Document Type: Article

Times cited : (17)

References (80)

1
- 0000371413
- (1958) J. Chem. Phys. , vol.28 , pp. 601
- Schneider, W.G.¹ Bernstein, H.J.² Pople, J.A.³

2
- 84946327888
- (1958) Mol. Phys. , vol.1 , pp. 223
- Stephen, M.J.¹

3
- 0000103150
- (1960) Can. J. Chem. , vol.38 , pp. 300
- Buckingham, A.D.¹

4
- 0000685251
- (1960) J. Chem. Phys. , vol.32 , pp. 1227
- Buckingham, A.D.¹ Schaefer, T.² Schneider, W.G.³

5
- 0000757103
- (1967) Adv. Chem. Phys. , vol.12 , pp. 107
- Buckingham, A.D.¹

6
- 0002453527
- (1994) J. Magn. Resort. , vol.107 , pp. 99
- Bishop, D.M.¹ Cybulski, S.M.²

7
- 0000378695
- (1997) J. Phys. Chem. , vol.101 , pp. 4105
- Nymand, T.M.¹ Åstrand, P.-O.² Mikkelsen, K.V.³

8
- 0000781102
- (1998) J. Chem. Phys. , vol.108 , pp. 2528
- Åstrand, P.-O.¹ Mikkelsen, K.V.² Jørgensen, P.³ Ruud, K.⁴ Helgaker, T.⁵

9
- 0039367138
- (1962) J. Chem. Phys. , vol.36 , pp. 3481
- Raynes, W.T.¹ Buckingham, A.D.² Bernstein, H.J.³

10
- 0000435803
- (1991) J. Am. Chem. Soc. , vol.113 , pp. 2447
- Augspurger, J.D.¹ Dykstra, C.E.² Oldfield, E.³

11
- 1542797184
- (1995) Annu. Rep. NMR Spectrosc. , vol.30 , pp. 1
- Augspurger, J.D.¹ Dykstra, C.E.²

12
- 44049112110
- (1992) J. Magn. Reson. , vol.100 , pp. 342
- Augspurger, J.D.¹ Pearson, J.G.² Oldfield, E.³ Dykstra, C.E.⁴ Park, K.D.⁵ Schwartz, D.⁶

13
- 0003495899
- edited by D. M. Grant and R. K. Harris (Wiley, London)
- (1996) Encyclopedia of NMR
- Raynes, W.T.¹

14
- 0007949461
- edited by J. A. Tossell (Kluwer Academic, Dordrecht)
- (1993) Nuclear Magnetic Shieldings and Molecular Structure , pp. 401
- Raynes, W.T.¹

15
- 0042916920
- edited by J. A. Tossell (Kluwer Academic, Dordrecht)
- (1993) Nuclear Magnetic Shieldings and Molecular Structure , pp. 75
- Augspurger, J.D.¹ Dykstra, C.E.² Oldfield, E.³ Pearson, J.G.⁴

16
- 0001925088
- edited by J. A. Tossell (Kluwer Academic, Dordrecht)
- (1993) Nuclear Magnetic Shieldings and Molecular Structure , pp. 95
- Jameson, C.J.¹ De Dios, A.C.²

17
- 2542526510
- (1994) Annu. Rep. NMR Spectrosc. , vol.29 , pp. 1
- De Dias, A.C.¹ Jameson, C.J.²

18
- 0007902962
- NMR, edited by G. A. Webb (The Chemical Society, London)
- (1993) Specialist Periodical Reports , vol.26
- Jameson, C.J.¹

19
- 0011521609
- (1994) Int. Rev. Phys. Chem. , vol.13 , pp. 21
- Bishop, D.M.¹

20
- 0000719180
- (1937) J. Phys. Radium , vol.8 , pp. 397
- London, F.¹

21
- 33751023272
- (1958) Mol. Phys. , vol.1 , pp. 203
- Hameka, H.F.¹

22
- 36849106175
- (1972) J. Chem. Phys. , vol.56 , pp. 5688
- Ditchfield, R.¹

23
- 40749094858
- (1974) Mol. Phys. , vol.27 , pp. 789
- Ditchfield, R.¹

24
- 11744305193
- (1990) J. Am. Chem. Soc. , vol.112 , pp. 8251
- Wolinski, K.¹ Hinton, J.F.² Pulay, P.³

25
- 0000389614
- (1980) Isr. J. Chem. , vol.19 , pp. 193
- Kutzelnigg, W.¹

26
- 36549098389
- (1985) J. Chem. Phys. , vol.82 , pp. 5035
- Hansen, A.E.¹ Bouman, T.D.²

27
- 4243914043
- (1990) Chem. Phys. Lett. , vol.175 , pp. 292
- Bouman, T.D.¹ Hansen, A.E.²

28
- 0000045224
- (1992) Chem. Phys. Lett. , vol.191 , pp. 614
- Gauss, J.¹

29
- 9444290281
- (1993) J. Chem. Phys. , vol.99 , pp. 3629
- Gauss, J.¹

30
- 0000469904
- (1993) Chem. Phys. Lett. , vol.205 , pp. 563
- Van Wüllen, C.¹ Kutzelnigg, W.²

31
- 0002861006
- (1994) Mol. Phys. , vol.81 , pp. 87
- Sauer, S.P.A.¹ Paidarova, I.² Oddershede, J.³

32
- 0009149697
- (1994) J. Chem. Phys. , vol.100 , pp. 8178
- Ruud, K.¹ Helgaker, T.² Kobayashi, R.³ Jørgensen, P.⁴ Bak, K.L.⁵ Jensen, H.J.A.⁶

33
- 0000781146
- (1994) Chem. Phys. Lett. , vol.229 , pp. 198
- Gauss, J.¹

34
- 36449001997
- (1995) J. Chem. Phys. , vol.102 , pp. 251
- Gauss, J.¹ Stanton, J.²

35
- 36449004178
- (1995) J. Chem. Phys. , vol.103 , pp. 3561
- Gauss, J.¹ Stanton, J.²

36
- 0000789447
- (1996) J. Chem. Phys. , vol.104 , pp. 2574
- Gauss, J.¹ Stanton, J.²

37
- 0034656439
- (2000) Phys. Chem. Chem. Phys. , vol.2 , pp. 2047
- Gauss, J.¹ Stanton, J.²

38
- 0000887063
- (1995) Ber. Bunsenges. Phys. Chem. , vol.99 , pp. 1001
- Gauss, J.¹

39
- 0000584523
- (1999) Chem. Rev. , vol.99 , pp. 293
- Helgaker, T.¹ Jaszuński, M.² Ruud, K.³

40
- 0003495899
- edited by D. M. Grant and R. K. Harris (Wiley, London)
- (1996) Encyclopedia of NMR , vol.7
- Kutzelnigg, W.¹ Fleischer, U.² Van Wüllen, C.³

41
- 0040490209
- (1995) J. Chem. Phys. , vol.102 , pp. 8953
- Rizzo, A.¹ Helgaker, T.² Ruud, K.³ Barszczewicz, A.⁴ Jaszuński, M.⁵ Jørgensen, P.⁶

42
- 2542604552
- (1995) Mol. Phys. , vol.88 , pp. 931
- Coriani, S.¹ Rizzo, A.² Ruud, K.³ Helgaker, T.⁴

43
- 0031569079
- (1997) Chem. Phys. , vol.216 , pp. 53
- Coriani, S.¹ Rizzo, A.² Ruud, K.³ Helgaker, T.⁴

44
- 0001086172
- (1993) Mol. Phys. , vol.80 , pp. 209
- Bishop, D.M.¹ Cybulski, S.M.²

45
- 0003281829
- (1998) Mol. Phys. , vol.93 , pp. 739
- Cybulski, S.M.¹ Bishop, D.M.²

46
- 0000564430
- (1994) J. Chem. Phys. , vol.101 , pp. 2180
- Bishop, D.M.¹ Cybulski, S.M.²

47
- 0001177596
- (1980) Chem. Phys. , vol.48 , pp. 157
- Roos, B.O.¹ Taylor, P.R.² Siegbahn, P.E.M.³

48
- 0000122016
- (1982) J. Chem. Phys. , vol.76 , pp. 1910
- Purvis, G.D.¹ Bartlett, R.J.²

49
- 0006244148
- (1989) Chem. Phys. Lett. , vol.157 , pp. 479
- Raghavachari, K.¹ Trucks, G.W.² Pople, J.A.³ Head-Gordon, M.⁴

50
- 0001619261
- (1997) J. Chem. Phys. , vol.106 , pp. 6430
- Helgaker, T.¹ Gauss, J.² Jørgensen, P.³ Olsen, J.⁴

51
- 0035870571
- (2001) J. Chem. Phys. , vol.114 , pp. 6548
- Bak, K.¹ Gauss, J.² Jørgensen, P.³ Olsen, J.⁴ Helgaker, T.⁵ Stanton, J.⁶

52
- 0001490016
- (2000) Chem. Phys. Lett. , vol.319 , pp. 563
- Bak, K.L.¹ Gauss, J.² Helgaker, T.³ Jørgensen, P.⁴ Olsen, J.⁵

53
- 0000488610
- (1998) J. Chem. Phys. , vol.109 , pp. 4745
- Christiansen, O.¹ Hättig, C.² Gauss, J.³

54
- 0001643690
- (1996) J. Chem. Phys. , vol.105 , pp. 11051
- Sundholm, D.¹ Gauss, J.² Schäfer, A.³

55
- 84947139485
- (1979) Mol. Phys. , vol.37 , pp. 571
- Raynes, W.T.¹ Ratcliffe, R.²

56
- 0003531355
- Blackwell Science, Oxford
- (1993) IUPAC, Physical Chemistry Division: Quantities, Units and Symbols in Physical Chemistry
- Mills, I.¹ Cvitas, T.² Homann, K.³ Kallay, N.⁴ Kuchitsu⁵

57
- 0007994825
- Technical report, University of Alberta, Edmonton, 1971
- Huzinaga, S.¹

58
- 0000871345
- (1994) Chem. Phys. Lett. , vol.222 , pp. 263
- Jaszuński, M.¹ Jørgensen, P.² Rizzo, A.³ Ruud, K.⁴ Helgaker, T.⁵

59
- 33746614482
- (1989) J. Chem. Phys. , vol.90 , pp. 1007
- Dunning, T.H.¹

60
- 4143095330
- (1992) J. Chem. Phys. , vol.96 , pp. 6796
- Kendall, R.A.¹ Dunning, T.H.² Harrison, R.J.³

61
- 26444474547
- (1994) J. Chem. Phys. , vol.100 , pp. 2975
- Woon, D.E.¹ Dunning, T.H.²

62
- 0003919078
- Van Nostrand-Reinhold, New York
- (1979) Molecular Spectra and Molecular Structure. Constants of Diatomic Molecules
- Huber, K.P.¹ Herzberg, G.H.²

63
- 0007896487
- (1980) J. Mol. Spectrosc. , vol.81 , pp. 110
- Carter, S.¹ Mills, I.M.² Murrell, J.N.³

64
- 0010957207
- (1976) J. Mol. Spectrosc. , vol.59 , pp. 103
- Strey, G.¹ Mills, I.M.²

65
- 84990669584
- (1992) Int. J. Quantum Chem., Quantum Chem. Symp. , vol.26 , pp. 879
- Stanton, J.F.¹ Gauss, J.² Watts, J.D.³ Lauderdale, W.J.⁴ Bartlett, R.J.⁵

66
- 0000256508
- (1993) Mol. Phys. , vol.80 , pp. 199
- Bishop, D.M.¹ Cybulski, S.M.²

67
- 0030574764
- (1996) Chem. Phys. Lett. , vol.250 , pp. 471
- Cybulski, S.M.¹ Bishop, D.²

68
- 36749105590
- (1981) J. Chem. Phys. , vol.74 , pp. 81
- Jameson, C.J.¹ Jameson, A.K.² Oppusunggu, D.³ Wille, S.⁴ Burrell, P.M.⁵ Mason, J.⁶

69
- 0007944766
- (1981) J. Chem. Phys. , vol.74 , pp. 853
- Jameson, C.J.¹ Jameson, A.K.² Wille, S.³ Burrell, P.M.⁴

70
- 0002417956
- (1977) J. Magn. Reson. , vol.27 , pp. 23
- Ishol, L.M.¹ Scott, T.A.²

71
- 0001435658
- (1977) J. Chem. Phys. , vol.66 , pp. 4977
- Jameson, C.J.¹

72
- 0001535484
- (1980) J. Chem. Phys. , vol.73 , pp. 6013
- Jameson, C.J.¹ Jameson, A.K.² Burrell, P.M.³

73
- 4243221983
- (1971) Chem. Phys. Lett. , vol.8 , pp. 470
- O'Reilley, D.E.¹ Peterson, E.M.² El Saffar, Z.M.³ Scheie, C.E.⁴

74
- 0000288734
- (1987) Chem. Phys. Lett. , vol.134 , pp. 461
- Jameson, A.K.¹ Jameson, C.J.²

75
- 0001735308
- (1991) Mol. Phys. , vol.72 , pp. 559
- Paidarova, I.¹ Komasa, J.² Oddershede, J.³

76
- 34247381172
- (1984) J. Chem. Phys. , vol.81 , pp. 1057
- Wasylishen, R.E.¹ Mooibroek, S.² Macdonald, J.B.³

77
- 0007994826
- (1968) J. Chem. Phys. , vol.48 , pp. 4142
- Hindermann, D.K.¹ Cornwell, C.D.²

78
- 0002027019
- (1977) Nucl. Magn. Reson. , vol.7 , pp. 1
- Raynes, W.T.¹

79
- 0004165142
- edited by P. Diehl, E. Fluck, H. Günther, R. Kosfeld, and J. Seelig (Springer, Berlin)
- (1991) NMR-Basic Principles and Progress , vol.23
- Kutzelnigg, W.¹ Fleischer, U.² Schindler, M.³

80
- 84994973832
- (1995) Magn. Reson. Chem. , vol.33 , pp. 138
- Grayson, M.¹ Raynes, W.T.²

* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.