-
4
-
-
33751157732
-
-
P. J. Stephens, F. J. Devlin, C. F. Chabalowski, and M. J. Frisch, J. Phys. Chem. 98, 11623 (1994).
-
(1994)
J. Phys. Chem.
, vol.98
, pp. 11623
-
-
Stephens, P.J.1
Devlin, F.J.2
Chabalowski, C.F.3
Frisch, M.J.4
-
9
-
-
0001652762
-
-
F. A. Hamprecht, A. J. Cohen, D. J. Tozer, and N. C. Handy, J. Chem. Phys. 109, 6264 (1998).
-
(1998)
J. Chem. Phys.
, vol.109
, pp. 6264
-
-
Hamprecht, F.A.1
Cohen, A.J.2
Tozer, D.J.3
Handy, N.C.4
-
10
-
-
0346189340
-
-
A. D. Boese, N. L. Doltsinis, N. C. Handy, and M. Sprik, J. Chem. Phys. 112, 1670 (2000).
-
(2000)
J. Chem. Phys.
, vol.112
, pp. 1670
-
-
Boese, A.D.1
Doltsinis, N.L.2
Handy, N.C.3
Sprik, M.4
-
15
-
-
0000211269
-
-
P. R E. Schipper, O. V. Gritsenko, S. J. A. van Gisbergen, and E. J. Baerends, J. Chem. Phys. 112, 1344 (2000).
-
(2000)
J. Chem. Phys.
, vol.112
, pp. 1344
-
-
Schipper, P.R.E.1
Gritsenko, O.V.2
Van Gisbergen, S.J.A.3
Baerends, E.J.4
-
19
-
-
35348906888
-
-
T. H. Dunning, J. Chem. Phys. 55, 716 (1971); S. Huzinaga, ibid. 42, 1293 (1965).
-
(1971)
J. Chem. Phys.
, vol.55
, pp. 716
-
-
Dunning, T.H.1
-
20
-
-
36849140788
-
-
T. H. Dunning, J. Chem. Phys. 55, 716 (1971); S. Huzinaga, ibid. 42, 1293 (1965).
-
(1965)
J. Chem. Phys.
, vol.42
, pp. 1293
-
-
Huzinaga, S.1
-
21
-
-
0001132752
-
-
J. P. Perdew, R. G. Parr, M. Levy, and J. L. Balduz, Phys. Rev. Lett. 49, 1691 (1982).
-
(1982)
Phys. Rev. Lett.
, vol.49
, pp. 1691
-
-
Perdew, J.P.1
Parr, R.G.2
Levy, M.3
Balduz, J.L.4
-
28
-
-
1542478809
-
-
A. J. Sadlej, Collect. Czech. Chem. Commun. 53, 1995 (1988); Theor. Chim. Acta 79, 123 (1991).
-
(1991)
Theor. Chim. Acta
, vol.79
, pp. 123
-
-
-
30
-
-
0001221550
-
-
A. J. Russell and M. A. Spackman, Mol. Phys. 84, 1239 (1995); 90, 251 (1997).
-
(1997)
Mol. Phys.
, vol.90
, pp. 251
-
-
-
33
-
-
0034702640
-
-
T. Helgaker, P. J. Wilson, R. D. Amos, and N. C. Handy, J. Chem. Phys. 113, 2983 (2000).
-
(2000)
J. Chem. Phys.
, vol.113
, pp. 2983
-
-
Helgaker, T.1
Wilson, P.J.2
Amos, R.D.3
Handy, N.C.4
-
36
-
-
0000330978
-
-
H. Bredohl, I. Dubois, Y. Houbrechts, and P. Nzohabonayo, J. Mol. Spectrosc. 112, 430 (1985).
-
(1985)
J. Mol. Spectrosc.
, vol.112
, pp. 430
-
-
Bredohl, H.1
Dubois, I.2
Houbrechts, Y.3
Nzohabonayo, P.4
-
37
-
-
0000502444
-
-
J. B. Burkholder, P. D. Hammer, C. J. Howard, and A. R. W. McKellar, J. Mol. Spectrosc. 118, 471 (1986).
-
(1986)
J. Mol. Spectrosc.
, vol.118
, pp. 471
-
-
Burkholder, J.B.1
Hammer, P.D.2
Howard, C.J.3
McKellar, A.R.W.4
-
38
-
-
0000551527
-
-
R. P. Tuckett, A. R. Dale, D. M. Jaffey, P. S. Jarrett, and T. Kelly. Mol. Phys. 49, 475 (1983).
-
(1983)
Mol. Phys.
, vol.49
, pp. 475
-
-
Tuckett, R.P.1
Dale, A.R.2
Jaffey, D.M.3
Jarrett, P.S.4
Kelly, T.5
-
40
-
-
37049062838
-
-
R. H. Jackson, J. Chem. Soc. 1962, 4585, (1962); K. C. Kim and G. M. Campbell, J. Mol. Struct. 129, 263 (1985).
-
(1962)
J. Chem. Soc.
, vol.1962
, pp. 4585
-
-
Jackson, R.H.1
-
43
-
-
0001762782
-
-
T. Tanaka and Y. Morino, J. Mol. Spectrosc. 33, 538 (1970); A. Barber, C. Secroun, and S. A. Clough, ibid. 49, 171 (1974).
-
(1970)
J. Mol. Spectrosc.
, vol.33
, pp. 538
-
-
Tanaka, T.1
Morino, Y.2
-
44
-
-
0000697984
-
-
T. Tanaka and Y. Morino, J. Mol. Spectrosc. 33, 538 (1970); A. Barber, C. Secroun, and S. A. Clough, ibid. 49, 171 (1974).
-
(1974)
J. Mol. Spectrosc.
, vol.49
, pp. 171
-
-
Barber, A.1
Secroun, C.2
Clough, S.A.3
-
46
-
-
0000923972
-
-
A. Jost, B. Rees, and W. B. Yelon, Acta Crystallogr., Sect. B: Struct. Crystallogr. Cryst. Chem. 31, 2649 (1975).
-
(1975)
Acta Crystallogr., Sect. B: Struct. Crystallogr. Cryst. Chem.
, vol.31
, pp. 2649
-
-
Jost, A.1
Rees, B.2
Yelon, W.B.3
-
52
-
-
84959186380
-
-
P. A. M. Dirac, Proc. Cambridge Philos. Soc. 26, 376 (1930); S. J. Vosko, L. Wilk, and M. Nusair, Can. J. Phys. 58, 1200 (1980).
-
(1930)
Proc. Cambridge Philos. Soc.
, vol.26
, pp. 376
-
-
Dirac, P.A.M.1
-
53
-
-
84959186380
-
-
P. A. M. Dirac, Proc. Cambridge Philos. Soc. 26, 376 (1930); S. J. Vosko, L. Wilk, and M. Nusair, Can. J. Phys. 58, 1200 (1980).
-
(1980)
Can. J. Phys.
, vol.58
, pp. 1200
-
-
Vosko, S.J.1
Wilk, L.2
Nusair, M.3
-
59
-
-
0001128619
-
-
6: J. Lorentzon, P.-A. Malmquist, M. Fulscher, and B. O. Roos, Theor. Chim. Acta 91, 91 (1995).
-
(1982)
Chem. Phys.
, vol.70
, pp. 291
-
-
Taylor, S.1
Wilden, D.G.2
Comer, J.3
-
60
-
-
0003067046
-
-
6: J. Lorentzon, P.-A. Malmquist, M. Fulscher, and B. O. Roos, Theor. Chim. Acta 91, 91 (1995).
-
(1995)
Theor. Chim. Acta
, vol.91
, pp. 91
-
-
Lorentzon, J.1
Malmquist, P.-A.2
Fulscher, M.3
Roos, B.O.4
-
61
-
-
0000287603
-
-
M. E. Casida, C. Jamorski, K. C. Casida, and D. R. Salahub, J. Chem. Phys. 108, 4439 (1998).
-
(1998)
J. Chem. Phys.
, vol.108
, pp. 4439
-
-
Casida, M.E.1
Jamorski, C.2
Casida, K.C.3
Salahub, D.R.4
-
63
-
-
0003096451
-
-
M. Bühl, M. Kaupp , O. L. Malkina, and V. G. Malkin, J. Comput. Chem. 20, 91 (1999).
-
(1999)
J. Comput. Chem.
, vol.20
, pp. 91
-
-
Bühl, M.1
Kaupp, M.2
Malkina, O.L.3
Malkin, V.G.4
-
68
-
-
0000183292
-
-
R. Bramley, M. Brorson, A. M. Sargeson, and C. E. Schaffer, J. Am. Chem. Soc. 107, 2780 (1985).
-
(1985)
J. Am. Chem. Soc.
, vol.107
, pp. 2780
-
-
Bramley, R.1
Brorson, M.2
Sargeson, A.M.3
Schaffer, C.E.4
-
72
-
-
33751157732
-
-
P. J. Stephens, F. J. Devlin, C. F. Chabalowski, and M. J. Frisch, J. Phys. Chem. 98, 11623 (1994).
-
(1994)
J. Phys. Chem.
, vol.98
, pp. 11623
-
-
Stephens, P.J.1
Devlin, F.J.2
Chabalowski, C.F.3
Frisch, M.J.4
-
77
-
-
0001652762
-
-
F. A. Hamprecht, A. J. Cohen, D. J. Tozer, and N. C. Handy, J. Chem. Phys. 109, 6264 (1998).
-
(1998)
J. Chem. Phys.
, vol.109
, pp. 6264
-
-
Hamprecht, F.A.1
Cohen, A.J.2
Tozer, D.J.3
Handy, N.C.4
-
78
-
-
0346189340
-
-
A. D. Boese, N. L. Doltsinis, N. C. Handy, and M. Sprik, J. Chem. Phys. 112, 1670 (2000).
-
(2000)
J. Chem. Phys.
, vol.112
, pp. 1670
-
-
Boese, A.D.1
Doltsinis, N.L.2
Handy, N.C.3
Sprik, M.4
-
83
-
-
0000211269
-
-
P. R. T. Schipper, O. V. Gritsenko, S. J. A. van Gisbergen, and E. J. Baerends, J. Chem. Phys. 112, 1344 (2000).
-
(2000)
J. Chem. Phys.
, vol.112
, pp. 1344
-
-
Schipper, P.R.T.1
Gritsenko, O.V.2
Van Gisbergen, S.J.A.3
Baerends, E.J.4
-
89
-
-
0001132752
-
-
J. P. Perdew, R. G. Parr, M. Levy, and J. L. Balduz, Phys. Rev. Lett. 49, 1691 (1982).
-
(1982)
Phys. Rev. Lett.
, vol.49
, pp. 1691
-
-
Perdew, J.P.1
Parr, R.G.2
Levy, M.3
Balduz, J.L.4
-
96
-
-
1542478809
-
-
Theor. Chim. Acta 79, 123 (1991).
-
(1991)
Theor. Chim. Acta
, vol.79
, pp. 123
-
-
-
101
-
-
0034702640
-
-
T. Helgaker, P. J. Wilson, R. D. Amos, and N. C. Handy, J. Chem. Phys. 113, 2983 (2000).
-
(2000)
J. Chem. Phys.
, vol.113
, pp. 2983
-
-
Helgaker, T.1
Wilson, P.J.2
Amos, R.D.3
Handy, N.C.4
-
104
-
-
0000330978
-
-
H. Bredohl, I. Dubois, Y. Houbrechts, and P. Nzohabonayo, J. Mol. Spectrosc. 112, 430 (1985).
-
(1985)
J. Mol. Spectrosc.
, vol.112
, pp. 430
-
-
Bredohl, H.1
Dubois, I.2
Houbrechts, Y.3
Nzohabonayo, P.4
-
105
-
-
0000502444
-
-
J. B. Burkholder, P. D. Hammer, C. J. Howard, and A. R. W. McKellar, J. Mol. Spectrosc. 118, 471 (1986).
-
(1986)
J. Mol. Spectrosc.
, vol.118
, pp. 471
-
-
Burkholder, J.B.1
Hammer, P.D.2
Howard, C.J.3
McKellar, A.R.W.4
-
106
-
-
0000551527
-
-
R. P. Tuckett, A. R. Dale, D. M. Jaffey, P. S. Jarrett, and T. Kelly, Mol. Phys. 49, 475 (1983).
-
(1983)
Mol. Phys.
, vol.49
, pp. 475
-
-
Tuckett, R.P.1
Dale, A.R.2
Jaffey, D.M.3
Jarrett, P.S.4
Kelly, T.5
-
114
-
-
0000923972
-
-
A. Jost, B. Rees, and W. B. Yelon, Acta Crystallogr., Sect. B: Struct. Crystallogr. Cryst. Chem. 31, 2649 (1975).
-
(1975)
Acta Crystallogr., Sect. B: Struct. Crystallogr. Cryst. Chem.
, vol.31
, pp. 2649
-
-
Jost, A.1
Rees, B.2
Yelon, W.B.3
-
128
-
-
0003067046
-
-
6: J. Lorentzon, P.-A. Malmquist, M. Fulscher, and B. O. Roos, Theor. Chim. Acta 91, 91 (1995).
-
(1995)
Theor. Chim. Acta
, vol.91
, pp. 91
-
-
Lorentzon, J.1
Malmquist, P.-A.2
Fulscher, M.3
Roos, B.O.4
-
129
-
-
0000287603
-
-
M. E. Casida, C. Jamorski, K. C. Casida, and D. R. Salahub, J. Chem. Phys. 108, 4439 (1998).
-
(1998)
J. Chem. Phys.
, vol.108
, pp. 4439
-
-
Casida, M.E.1
Jamorski, C.2
Casida, K.C.3
Salahub, D.R.4
-
131
-
-
0003096451
-
-
M. Bühl, M. Kaupp, O. L. Malkina, and V. G. Malkin, J. Comput. Chem. 20, 91 (1999).
-
(1999)
J. Comput. Chem.
, vol.20
, pp. 91
-
-
Bühl, M.1
Kaupp, M.2
Malkina, O.L.3
Malkin, V.G.4
-
136
-
-
0000183292
-
-
R. Bramley, M. Brorson, A. M. Sargeson, and C. E. Schaffer, J. Am. Chem. Soc. 107, 2780 (1985).
-
(1985)
J. Am. Chem. Soc.
, vol.107
, pp. 2780
-
-
Bramley, R.1
Brorson, M.2
Sargeson, A.M.3
Schaffer, C.E.4
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