SCOPUS 정보 검색 플랫폼

Volumn 41, Issue 12, 2002, Pages 3091-3101

Interpretation of indirect nuclear spin-spin coupling tensors for polyatomic xenon fluorides and group 17 fluorides: Results from relativistic density-functional calculations

(2) Bryce, David L a,b Wasylishen, Roderick E a

a DALHOUSIE UNIVERSITY (Canada)

b UNIVERSITY OF ALBERTA (Canada)

Author keywords

[No Author keywords available]

Indexed keywords

CHLORINE DERIVATIVE; FLUORIDE; POTASSIUM DERIVATIVE; XENON;

ACCELERATION; ARTICLE; CHEMICAL BOND; ELECTRIC FIELD; NUCLEAR MAGNETIC RESONANCE; STRUCTURE ANALYSIS;

EID: 0037124475 PISSN: 00201669 EISSN: None Source Type: Journal
DOI: 10.1021/ic020025u Document Type: Article

Times cited : (29)

References (113)

1
- 0034920118
- (2001) Annu. Rev. Phys. Chem. , vol.52 , pp. 463-498
- Frydman, L.¹

2
- 0004099399
- Mason, J.; Ed.; Plenum Press: New York
- (1987) Multinuclear NMR

3
- 0004040988
- C.F.C. Press: Guelph, ON
- (1983) Solid State NMR for Chemists
- Fyfe, C.A.¹

4
- 0000584523
- (1999) Chem. Rev. , vol.99 , pp. 293-352
- Helgaker, T.¹ Jaszuński, M.² Ruud, K.³

5
- 0000716445
- (1999) Prog. Nucl. Magn. Reson. Spectrosc. , vol.35 , pp. 267-294
- Fukui, H.¹

6
- 0009468212
- Webb, G.A., Ed.; Royal Society of Chemistry: Cambridge; Chapter 4. See also previous volumes in this series
- (2000) Nuclear Magnetic Resonance: Specialist Periodical Report , vol.29
- Fukui, H.¹

7
- 35448947580
- (2000) Annu. Rep. Nucl. Magn. Reson. Spectrosc. , vol.41 , pp. 55-184
- Contreras, R.H.¹ Peralta, J.E.² Giribet, C.G.³ Ruiz de Azúa, M.C.⁴ Facelli, J.C.⁵

8
- 77956854290
- (1993) Annu. Rep. Nucl. Magn. Reson. Spectrosc. , vol.27 , pp. 255-356
- Contreras, R.H.¹ Facelli, J.C.²

9
- 0001185992
- (1992) J. Chem. Phys. , vol.96 , pp. 6120-6125
- Vahtras, O.¹ Ågren, H.² Jørgensen, P.³ Jensen, H.J.A.⁴ Padkjær, S.B.⁵ Helgaker, T.⁶

10
- 0031557299
- (1997) Chem. Phys. Lett. , vol.266 , pp. 456-464
- Nooijen, M.¹ Perera, S.A.² Bartlett, R.J.³

11
- 0032509032
- (1998) Theor. Chem. Acc. , vol.100 , pp. 275-284
- Enevoldsen, T.¹ Oddershede, J.² Sauer, S.P.A.³

12
- 0002646002
- (1999) J. Comput. Chem. , vol.20 , pp. 1314-1327
- Vaara, J.¹ Ruud, K.² Vahtras, O.³

13
- 0000280315
- (1999) J. Comput. Chem. , vol.20 , pp. 1262-1273
- Visscher, L.¹ Enevoldsen, T.² Saue, T.³ Jensen, H.J.A.⁴ Oddershede, J.⁵

14
- 43949161745
- (1994) Chem. Phys. Lett. , vol.221 , pp. 91-99
- Malkin, V.G.¹ Malkina, O.L.² Salahub, D.R.³

15
- 0001010310
- (1996) J. Chem. Phys. , vol.105 , pp. 8793-8800
- Malkina, O.L.¹ Salahub, D.R.² Malkin, V.G.³

16
- 0034271229
- (2000) J. Chem. Phys. , vol.113 , pp. 3530-3547
- Sychrovský, V.¹ Gräfenstein, J.² Cremer, D.³

17
- 0034511587
- (2000) J. Chem. Phys. , vol.113 , pp. 9402-9409
- Helgaker, T.¹ Watson, M.² Handy, N.C.³

18
- 0035308228
- (2001) J. Chem. Phys. , vol.114 , pp. 5482-5490
- Lantto, P.¹ Vaara, J.²

19
- 0035933968
- (2001) J. Chem. Phys. , vol.115 , pp. 1619-1622
- Auer, A.A.¹ Gauss, J.²

20
- 0001704573
- (2000) J. Chem. Phys. , vol.112 , pp. 3493-3498
- Enevoldsen, T.¹ Visscher, L.² Saue, T.³ Jensen, H.J.A.⁴ Oddershede, J.⁵

21
- 0003838469
- Wiley-VCH: Weinheim; Chapter 11
- (2000) A Chemist's Guide to Density Functional Theory
- Koch, W.¹ Holthausen, M.C.²

22
- 0034228753
- (2000) J. Chem. Phys. , vol.113 , pp. 936-947
- Autschbach, J.¹ Ziegler, T.²

23
- 0034498924
- (2000) J. Chem. Phys. , vol.113 , pp. 9410-9418
- Autschbach, J.¹ Ziegler, T.²

24
- 0034837217
- (2001) J. Am. Chem. Soc. , vol.123 , pp. 3341-3349
- Autschbach, J.¹ Ziegler, T.²

25
- 0034811814
- (2001) J. Am. Chem. Soc. , vol.123 , pp. 5320-5324
- Autschbach, J.¹ Ziegler, T.²

26
- 0035901631
- and references therein
- (2001) Angew. Chem., Int. Ed. , vol.40 , pp. 1419-1421
- Christe, K.O.¹

27
- 0034613364
- (2000) Science , vol.290 , pp. 117-118
- Seidel, S.¹ Seppelt, K.²

28
- 0034710655
- (2000) Nature , vol.406 , pp. 874-876
- Khriachtchev, L.¹ Pettersson, M.² Runeberg, N.³ Lundell, J.⁴ Räsänen, M.⁵

29
- 0035907446
- (2001) Inorg. Chem. , vol.40 , pp. 3002-3017
- Lehmann, J.F.¹ Dixon, D.A.² Schrobilgen, G.J.³

30
- 0037185308
- (2002) Inorg. Chem. , vol.41 , pp. 198-204
- Gerken, M.¹ Schrobilgen, G.J.²

31
- 0033829819
- (2000) Coord. Chem. Rev. , vol.197 , pp. 335-395
- Gerken, M.¹ Schrobilgen, G.J.²

32
- 0034811604
- (2001) J. Am. Chem. Soc. , vol.123 , pp. 6338-6348
- Christe, K.O.¹ Zhang, X.² Sheehy, J.A.³ Bau, R.⁴

33
- 0035820568
- (2001) Inorg. Chem. , vol.40 , pp. 2415-2419
- Schroer, T.¹ Christe, K.O.²

34
- 0009527429
- (2000) Russ. J. Inorg. Chem. , vol.45 , pp. 1369-1378
- Charkin, O.P.¹ Klimenko, N.M.² McKee, M.L.³

35
- 8744276163
- (2000) Zh. Neorg. Khim. , vol.45 , pp. 1498-1507

36
- 0032483702
- (1998) J. Am. Chem. Soc. , vol.120 , pp. 11115-11121
- Pak, C.¹ Xie, Y.² Van Huis, T.J.³ Schaefer H.F. III⁴

37
- 0000925871
- (1996) J. Phys. Chem. , vol.100 , pp. 2968-2973
- Schwerdtfeger, P.¹

38
- 0024815212
- (1989) Angew. Chem., Int. Ed. Engl. , vol.28 , pp. 1526-1527
- Mahjoub, A.R.¹ Hoser, A.² Fuchs, J.³ Seppelt, K.⁴

39
- 0029853378
- (1996) J. Am. Chem. Soc. , vol.118 , pp. 11939-11950
- Kaupp, M.¹ Van Wüllen, Ch.² Franke, R.³ Schmitz, F.⁴ Kutzelnigg, W.⁵

40
- 0000824033
- (1996) Mol. Phys. , vol.89 , pp. 607-631
- Van Huis, T.J.¹ Galbraith, J.M.² Schaefer H.F. III³

41
- 13344280400
- (1993) Coord. Chem. Rev. , vol.126 , pp. 149-175
- Buslaev, Yu.A.¹ Klyagina, A.P.²

42
- 84989549430
- (1995) Chem. Eur. J. , vol.1 , pp. 261-265
- Mahjoub, A.R.¹ Zhang, X.² Seppelt, K.³

43
- 0000357126
- (1974) Inorg. Chem. , vol.13 , pp. 1230-1235
- Gillespie, R.J.¹ Schrobilgen, G.J.²

44
- 0000677589
- (1974) Can. J. Chem. , vol.52 , pp. 3676-3681
- Alexandre, M.¹ Rigny, P.²

45
- 4243734471
- (1972) Inorg. Chem. , vol.11 , pp. 656-658
- Brownstein, M.¹ Selig, H.²

46
- 84986366173
- (1993) Heteroat. Chem. , vol.4 , pp. 543-552
- Tornieporth-Oetting, I.C.¹ Klapötke, T.M.²

47
- 0000124377
- (1973) Inorg. Chem. , vol.12 , pp. 1580-1587
- Christe, K.O.¹

48
- 33748247702
- (1991) Angew. Chem., Int. Ed. Engl. , vol.30 , pp. 323-324
- Mahjoub, A.R.¹ Seppelt, K.²

49
- 0003603208
- Allyn and Bacon: Boston
- (1991) The VSEPR Model of Molecular Geometry
- Gillespie, R.J.¹ Hargittai, I.²

50
- 0009527309
- Butterworth-Heinemann: Oxford, UK; Chapter 4
- (1995) Molecular Geometry
- Rodger, A.¹ Rodger, P.M.²

51
- 0034607306
- (2000) J. Am. Chem. Soc. , vol.122 , pp. 3197-3205
- Bryce, D.L.¹ Wasylishen, R.E.²

52
- 0036571189
- (2002) J. Am. Chem. Soc. , vol.124 , pp. 4894-4900
- Bryce, D.L.¹ Wasylishen, R.E.² Autschbach, J.³ Ziegler, T.⁴

53
- 0034669262
- (2000) J. Am. Chem. Soc. , vol.122 , pp. 11236-11237
- Bryce, D.L.¹ Wasylishen, R.E.²

54
- 0037045313
- (2002) J. Mol. Struct. , vol.602-603 , pp. 463-472
- Bryce, D.L.¹ Wasylishen, R.E.²

55
- 37049065288
- (1963) Trans. Faraday Soc. , vol.59 , pp. 2421-2430
- Buckingham, A.D.¹ Pople, J.A.²

56
- 0000300467
- (1970) J. Magn. Reson. , vol.2 , pp. 338-351
- Buckingham, A.D.¹ Love, I.²

57
- 0000354749
- (1982) Phys. Rep. , vol.86 , pp. 363-401
- Robert, J.B.¹ Wiesenfeld, L.²

58
- 0002657555
- Grant, D. M., Harris, R. K., Eds.; Wiley Inc.: Chichester, U.K.
- (1996) Encyclopedia of Nuclear Magnetic Resonance , pp. 1685-1695
- Wasylishen, R.E.¹

59
- 0000825653
- (1968) Mol. Phys. , vol.15 , pp. 157-165
- Andrew, E.R.¹ Farnell, L.F.²

60
- 0002210634
- Diehl, P., Fluck, E., Kosfeld, R., Eds.; Springer-Verlag: Berlin
- (1978) NMR Basic Principles and Progress , vol.15 , pp. 55-214
- Spiess, H.W.¹

61
- 36149019129
- (1953) Phys. Rev. , vol.91 , pp. 303-307
- Ramsey, N.F.¹

62
- 0034406345
- (2000) Theor. Chem. Acc. , vol.103 , pp. 214-216
- Pyykkö, P.¹

63
- 0009539940
- Reference 2, Chapter 3, Figure 1

64
- 0000791222
- (1977) Chem. Phys. , vol.22 , pp. 289-296
- Pyykkö, P.¹

65
- 0000369356
- (1996) J. Phys. Chem. , vol.100 , pp. 5286-5290
- Dickson, R.M.¹ Ziegler, T.²

66
- 0000819301
- (1999) Spectrochim. Acta , vol.A55 , pp. 607-624
- Khandogin, J.¹ Ziegler, T.²

67
- 0004066445
- ADF 2000.01, Vrije Universiteit: Amsterdam
- Theoretical Chemistry

68
- 0038023343
- (1973) Chem. Phys. , vol.2 , pp. 41-51
- Baerends, E.J.¹ Ellis, D.E.² Ros, P.³

69
- 36549093268
- (1988) J. Chem. Phys. , vol.88 , pp. 322-328
- Versluis, L.¹ Ziegler, T.²

70
- 28144440701
- (1992) J. Comput. Phys. , vol.99 , pp. 84-98
- Te Velde, G.¹ Baerends, E.J.²

71
- 0032221816
- (1998) Theor. Chem. Acc. , vol.99 , pp. 391-403
- Fonseca Guerra, C.¹ Snijders, J.G.² Te Velde, G.³ Baerends, E.J.⁴

72
- 0000216001
- (1980) Can. J. Phys. , vol.58 , pp. 1200-1211
- Vosko, S.H.¹ Wilk, L.² Nusair, M.³

73
- 4243553426
- (1988) Phys. Rev. A , vol.38 , pp. 3098-3100
- Becke, A.D.¹

74
- 5944261746
- (1986) Phys. Rev. B , vol.33 , pp. 8822-8824
- Perdew, J.P.¹

75
- 4043083704
- (1986) Phys. Rev. B , vol.34 , pp. 7406

77
- 33751554101
- (1990) J. Phys. Chem. , vol.94 , pp. 5477-5482
- Malmqvist, P.-Å.¹ Rendell, A.² Roos, B.O.³

78
- 0347090848
- (1988) J. Chem. Phys. , vol.88 , pp. 3834-3839
- Jensen, H.J.Aa.¹ Jørgensen, P.² Ågren, H.³ Olsen, J.⁴

79
- 21544434105
- (1998) J. Chem. Phys. , vol.109 , pp. 8168-8181
- Guilleme, J.¹ Fabián, J.S.²

80
- 33746614482
- (1989) J. Chem. Phys. , vol.90 , pp. 1007-1023
- Dunning T.H., Jr.¹

81
- 3843146349
- (1993) J. Chem. Phys. , vol.98 , pp. 1358-1371
- Woon, D.E.¹ Dunning T.H., Jr.²

82
- 36449006587
- (1995) J. Chem. Phys. , vol.103 , pp. 4572-4585
- Woon, D.E.¹ Dunning T.H., Jr.²

83
- 0001672302
- (1991) Inorg. Chem. , vol.30 , pp. 102-109
- Bougon, R.¹ Cicha, W.V.² Lance, M.³ Meublat, L.⁴ Nierlich, M.⁵ Vigner, J.⁶

84
- 36849135152
- (1953) J. Chem. Phys. , vol.21 , pp. 609-614
- Smith, D.F.¹

85
- 0001155905
- (1990) J. Chem. Phys. , vol.93 , pp. 121-125
- Haubrich, S.T.¹ Roehrig, M.A.² Kukolich, S.G.³

86
- 37049140050
- (1975) J. Chem. Soc., Dalton Trans. , pp. 2174-2177
- Edwards, A.J.¹ Taylor, P.²

87
- 0009471383
- Unpublished work
- (2001)
- Lehmann, J.F.¹ Schrobilgen, G.J.²

88
- 0001739869
- (1957) J. Chem. Phys. , vol.27 , pp. 223-226
- Magnuson, D.W.¹

89
- 0009535731
- (1978) J. Chem. Soc., Faraday Trans. 2 , vol.74 , pp. 1208-1213
- Brassington, N.J.¹ Edwards, H.G.M.² Long, D.A.³

90
- 0001570288
- (1974) Inorg. Chem. , vol.13 , pp. 1690-1694
- Boldrini, P.¹ Gillespie, R.J.² Ireland, P.R.³ Schrobilgen, G.J.⁴

91
- 0009470295
- (1989) Dokl. Phys. Chem. , vol.305 , pp. 332-335
- Ivashkevich, L.S.¹ Ishchenko, A.A.² Kiselev, Yu.M.³ Romanov, G.V.⁴ Sokolov, V.B.⁵ Spiridonov, V.P.⁶

92
- 0009467984
- (1989) Dokl. Akad. Nauk SSSR , vol.305 , pp. 1396-1400

93
- 0000094381
- (1991) J. Am. Chem. Soc. , vol.113 , pp. 3351-3361
- Christe, K.O.¹ Curtis, E.C.² Dixon, D.A.³ Mercier, H.P.⁴ Sanders, J.C.P.⁵ Schrobilgen, G.J.⁶

94
- 0001068872
- (1973) Inorg. Chem. , vol.12 , pp. 1726-1730
- Leary, K.¹ Templeton, D.H.² Zalkin, A.³ Bartlett, N.⁴

96
- 0000726034
- (1993) J. Am. Chem. Soc. , vol.115 , pp. 9461-9467
- Christe, K.O.¹ Dixon, D.A.² Sanders, J.C.P.³ Schrobilgen, G.J.⁴ Wilson, W.W.⁵

97
- 0000307058
- (1995) J. Chem. Phys. , vol.103 , pp. 577-583
- Müller, H.S.P.¹ Gerry, M.C.L.²

98
- 0000265632
- (1981) Inorg. Chem. , vol.20 , pp. 2118-2129
- Keller, N.¹ Schrobilgen, G.J.²

99
- 0009468348
- (1976) R. Acad. Sci. Paris Ser. C , vol.282 , pp. 519-521
- Holloway, J.H.¹ Schrobilgen, G.J.² Granger, P.³ Brevard, C.C.⁴

100
- 33947094656
- (1978) Inorg. Chem. , vol.17 , pp. 980-987
- Schrobilgen, G.J.¹ Holloway, J.H.² Granger, P.³ Brevard, C.⁴

101
- 0035396931
- (2001) J. Chem. Phys. , vol.115 , pp. 26-42
- Patchkovskii, S.¹ Autschbach, J.² Ziegler, T.³

102
- 0001377197
- (1982) Inorg. Chem. , vol.21 , pp. 1068-1073
- Birchall, T.¹ Myers, R.D.² De Waard, H.³ Schrobilgen, G.J.⁴

103
- 33847805769
- (1974) Inorg. Chem. , vol.13 , pp. 1455-1459
- Gillespie, R.J.¹ Netzer, A.² Schrobilgen, G.J.³

104
- 0002708032
- (1976) Inorg. Chem. , vol.15 , pp. 22-31
- Gillespie, R.J.¹ Schrobilgen, G.J.²

105
- 84989046059
- (1994) Magn. Reson. Chem. , vol.32 , pp. 242-247
- Jokisaari, J.P.¹ Ingman, L.P.² Schrobilgen, G.J.³ Sanders, J.C.P.⁴

106
- 0035951578
- and references therein
- (2001) J. Org. Chem. , vol.66 , pp. 496-500
- Rozen, S.¹ Ben-David, I.²

107
- 0000104489
- (1974) Inorg. Chem. , vol.13 , pp. 2370-2374
- Gillespie, R.J.¹ Schrobilgen, G.J.²

108
- 0000516483
- (1974) Inorg. Chem. , vol.13 , pp. 765-770
- Gillespie, R.J.¹ Schrobilgen, G.J.²

109
- 33947086437
- (1973) Inorg. Chem. , vol.12 , pp. 84-89
- Christe, K.O.¹ Hon, J.F.² Pilipovich, D.³

110
- 0009470296
- (1970) J. Chem. Phys. , vol.52 , pp. 1960-1962
- Hon, J.F.¹ Christe, K.O.²

111
- 0009529058
- See ref 2, Chapter 4, Section 2.2.1

112
- 84989078163
- (1989) Magn. Reson. Chem. , vol.27 , pp. 409-430
- Gil, V.M.S.¹ Von Philipsborn, W.²

113
- 36749110351
- (1977) J. Chem. Phys. , vol.66 , pp. 5274-5277
- Fabricant, B.¹ Muenter, J.S.²

* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.