-
1
-
-
1142284073
-
-
Rowe, W. F., Duerst, R. W., and Wilson, E. B., 1976, J. Am. chem. Soc., 98, 402.
-
(1976)
J. Am. Chem. Soc.
, vol.98
, pp. 402
-
-
Rowe, W.F.1
Duerst, R.W.2
Wilson, E.B.3
-
2
-
-
33845557684
-
-
Baugchum, S. L., Duerst, R. W., Rowe, W. F., Smith, Z., and Wilson, E. B., 1981, J. Am. chem. Soc., 103, 6296.
-
(1981)
J. Am. Chem. Soc.
, vol.103
, pp. 6296
-
-
Baugchum, S.L.1
Duerst, R.W.2
Rowe, W.F.3
Smith, Z.4
Wilson, E.B.5
-
3
-
-
0021409432
-
-
Baugchum, S. L., Smith, Z., Wilson, E. B., and Duerst, R. W., 1984, J. Am. chem. Soc., 106, 2260.
-
(1984)
J. Am. Chem. Soc.
, vol.106
, pp. 2260
-
-
Baugchum, S.L.1
Smith, Z.2
Wilson, E.B.3
Duerst, R.W.4
-
4
-
-
0021411708
-
-
Turner, P., Baughchum, S. L., Coy, S. L., and Smith, Z., 1984, J. Am. chem. Soc., 106, 2265.
-
(1984)
J. Am. Chem. Soc.
, vol.106
, pp. 2265
-
-
Turner, P.1
Baughchum, S.L.2
Coy, S.L.3
Smith, Z.4
-
5
-
-
0000392674
-
-
Firth, D. W., Beyer, K., Dvorak, M. A., Reeve, S. W., Grushow, A., and Leopold, K., 1991, J. chem. Phys., 94, 1812.
-
(1991)
J. Chem. Phys.
, vol.94
, pp. 1812
-
-
Firth, D.W.1
Beyer, K.2
Dvorak, M.A.3
Reeve, S.W.4
Grushow, A.5
Leopold, K.6
-
6
-
-
0001083185
-
-
Baba, T., Tanaka, T., Morino, I., Yamada, K. M. T., and Tanaka, K., 1999, J. chem. Phys., 110, 4131.
-
(1999)
J. Chem. Phys.
, vol.110
, pp. 4131
-
-
Baba, T.1
Tanaka, T.2
Morino, I.3
Yamada, K.M.T.4
Tanaka, K.5
-
7
-
-
0001361733
-
-
Seliskar, C. J., and Hoffmann, R. E., 1982, J. molec. Spectrosc., 96, 146.
-
(1982)
J. Molec. Spectrosc.
, vol.96
, pp. 146
-
-
Seliskar, C.J.1
Hoffmann, R.E.2
-
8
-
-
0001070578
-
-
Smith, Z., Wilson, E. B., and Duerst, R. W., 1983, Spectrochim. Acta A, 39, 1117.
-
(1983)
Spectrochim. Acta A
, vol.39
, pp. 1117
-
-
Smith, Z.1
Wilson, E.B.2
Duerst, R.W.3
-
9
-
-
45349109474
-
-
Firth, D. W., Barbara, P. F., and Trommsdorf, H. P., 1989, Chem. Phys., 136, 349.
-
(1989)
Chem. Phys.
, vol.136
, pp. 349
-
-
Firth, D.W.1
Barbara, P.F.2
Trommsdorf, H.P.3
-
10
-
-
0001013201
-
-
Chiavassa, T., Roubin, P., Pizzala, L., Verlaque, P., Allouche, A., and Marinelli, F., 1992, J. phys. Chem., 96, 10659.
-
(1992)
J. Phys. Chem.
, vol.96
, pp. 10659
-
-
Chiavassa, T.1
Roubin, P.2
Pizzala, L.3
Verlaque, P.4
Allouche, A.5
Marinelli, F.6
-
11
-
-
0000905542
-
-
Barone, V., and Adamo, C., 1996, J. chem. Phys., 105, 11007.
-
(1996)
J. Chem. Phys.
, vol.105
, pp. 11007
-
-
Barone, V.1
Adamo, C.2
-
12
-
-
0000983566
-
-
Sirois, S., Proynov, E. I., Nguyen, D. T., and Salahub, D. R., 1997, J. chem. Phys., 107, 6770.
-
(1997)
J. Chem. Phys.
, vol.107
, pp. 6770
-
-
Sirois, S.1
Proynov, E.I.2
Nguyen, D.T.3
Salahub, D.R.4
-
13
-
-
0001183585
-
-
Sobolewski, A. L., and Domke, W., 1999, J. phys. Chem. A, 103, 4494.
-
(1999)
J. Phys. Chem. A
, vol.103
, pp. 4494
-
-
Sobolewski, A.L.1
Domke, W.2
-
14
-
-
0035894402
-
-
Yagi, K., Takaetuga, T., and Hirao, K., 2001, J. chem. Phys., 115, 10647.
-
(2001)
J. Chem. Phys.
, vol.115
, pp. 10647
-
-
Yagi, K.1
Takaetuga, T.2
Hirao, K.3
-
15
-
-
0002599819
-
-
Sadhukhan, S., Muñoz, D., Adamo, C., and Scuseria, G. E., 1999, Chem. Phys. Lett., 306, 83.
-
(1999)
Chem. Phys. Lett.
, vol.306
, pp. 83
-
-
Sadhukhan, S.1
Muñoz, D.2
Adamo, C.3
Scuseria, G.E.4
-
16
-
-
0034672666
-
-
Benderskii, V. A., Vetoshkin, E. V., Irgibaeva, I. S., and Trommsdorff, H. P., 2000, Chem. Phys., 262, 393.
-
(2000)
Chem. Phys.
, vol.262
, pp. 393
-
-
Benderskii, V.A.1
Vetoshkin, E.V.2
Irgibaeva, I.S.3
Trommsdorff, H.P.4
-
17
-
-
0035450179
-
-
Benderskii, V. A., Vetoshkin, E. V., and Trommsdorff, H. P., 2001, Chem. Phys., 271, 165.
-
(2001)
Chem. Phys.
, vol.271
, pp. 165
-
-
Benderskii, V.A.1
Vetoshkin, E.V.2
Trommsdorff, H.P.3
-
18
-
-
0036678159
-
-
Tautermann, C. F., Voegele, A. F., Loerting, T., and Liedl, K. R., 2002, J. chem. Phys., 117, 1962, 1967.
-
(2002)
J. Chem. Phys.
, vol.117
-
-
Tautermann, C.F.1
Voegele, A.F.2
Loerting, T.3
Liedl, K.R.4
-
19
-
-
0035886126
-
-
Mil'nikov, G. V., and Nakamura, H., 2001, J. chem. Phys., 115, 6881.
-
(2001)
J. Chem. Phys.
, vol.115
, pp. 6881
-
-
Mil'nikov, G.V.1
Nakamura, H.2
-
20
-
-
0037770093
-
-
Mil'nikov, G. V., Yagi, K., Taketsugu, T., Nakamura, H., and Hirao, K., 2003, J. chem. Phys., 119, 10.
-
(2003)
J. Chem. Phys.
, vol.119
, pp. 10
-
-
Mil'nikov, G.V.1
Yagi, K.2
Taketsugu, T.3
Nakamura, H.4
Hirao, K.5
-
21
-
-
0037205061
-
-
Babic, D., Bosanac, S. D., and Doslic, N., 2002, Chem. Phys. Lett., 358, 337.
-
(2002)
Chem. Phys. Lett.
, vol.358
, pp. 337
-
-
Babic, D.1
Bosanac, S.D.2
Doslic, N.3
-
22
-
-
0037405031
-
-
Alparone, A., and Millefiori, S., 2003, Chem. Phys., 290, 15.
-
(2003)
Chem. Phys.
, vol.290
, pp. 15
-
-
Alparone, A.1
Millefiori, S.2
-
23
-
-
0348203651
-
-
Tayyari, S. F., and Milani-Nejad, F., 1998, Spectrochim. Acta A, 54, 255.
-
(1998)
Spectrochim. Acta A
, vol.54
, pp. 255
-
-
Tayyari, S.F.1
Milani-Nejad, F.2
-
24
-
-
6944251055
-
-
Møller, C., and Plesset, M. S., 1934, Phys. Rev., 46, 618.
-
(1934)
Phys. Rev.
, vol.46
, pp. 618
-
-
Møller, C.1
Plesset, M.S.2
-
25
-
-
1142296094
-
-
Pople, J. A., Binkley, J. S., and Seeger, R., 1970, Int. J. quantum Chem. Symp., 10, 1.
-
(1970)
Int. J. Quantum Chem. Symp.
, vol.10
, pp. 1
-
-
Pople, J.A.1
Binkley, J.S.2
Seeger, R.3
-
26
-
-
3843146349
-
-
Woon, D. E., and Dunning, Jr., T. H., 1993, J. chem. Phys., 98, 1358.
-
(1993)
J. Chem. Phys.
, vol.98
, pp. 1358
-
-
Woon, D.E.1
Dunning Jr., T.H.2
-
27
-
-
1142308309
-
-
Kendall, R. A., Dunning Jr., T. H., and Harrison, R. J., 1992, J. chem. Phys., 96, 6795.
-
(1992)
J. Chem. Phys.
, vol.96
, pp. 6795
-
-
Kendall, R.A.1
Dunning Jr., T.H.2
Harrison, R.J.3
-
29
-
-
0010952915
-
-
Lee, C., Yang, W., and Parr, R. G., 1988, Phys. Rev. B, 37, 758.
-
(1988)
Phys. Rev. B
, vol.37
, pp. 758
-
-
Lee, C.1
Yang, W.2
Parr, R.G.3
-
30
-
-
36549091139
-
-
Frisch, M. J., Pople, J. A., and Binkley, J. S., 1964, J. chem. Phys., 80, 3265.
-
(1964)
J. Chem. Phys.
, vol.80
, pp. 3265
-
-
Frisch, M.J.1
Pople, J.A.2
Binkley, J.S.3
-
31
-
-
0004133516
-
-
(Pittsburgh, PA: Gaussian, Inc.)
-
Frisch, M. J., Trucks, G. W., Schlegel, H. B., Scuseria, G. E., Robb, M. A., Cheeseman, J. R., Zakrzewski, V. G., Montgomery, J. A., Stratmann, R. E., Burant, J. C., Dapprich, S., Millam, J. M., Daniels, A. D., Kudin, K. N., Strain, M. C., Farkas, O., Tomasi, J., Barone, V., Cossi, M., Cammi, R., Menucci, B., Pomelli, C., Clifford, S., Ochterski, J., Peterson, G. A., Ayala, P. Y., Cui, Q., Morokuma, K., Malick, D. K., Rabuck, A. D., Raghavachari, K., Foresman, J. B., Cioslowski, J., Ortiz, J. V., Babul, A. G., Stefanov, B. B., Liu, G., Liashenko, A., Piskorz, P., Komaromi, I., Gomperts, R., Martin, R. L., Fox, D. J., Keith, T., Al-Laham, M. A., Peng, C. Y., Nanayakkara, A., Challacombe, M., Gill, P. M. W., Johnson, B., Chen, W., Wong, M. W., Andres, J. L., Gonzalez, C., Head-Gordon, M., Replogle, E. S., and Pople, J. A., 1998, Gaussian 98, revision A.9 (Pittsburgh, PA: Gaussian, Inc.).
-
(1998)
Gaussian 98, Revision A.9
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
Scuseria, G.E.4
Robb, M.A.5
Cheeseman, J.R.6
Zakrzewski, V.G.7
Montgomery, J.A.8
Stratmann, R.E.9
Burant, J.C.10
Dapprich, S.11
Millam, J.M.12
Daniels, A.D.13
Kudin, K.N.14
Strain, M.C.15
Farkas, O.16
Tomasi, J.17
Barone, V.18
Cossi, M.19
Cammi, R.20
Menucci, B.21
Pomelli, C.22
Clifford, S.23
Ochterski, J.24
Peterson, G.A.25
Ayala, P.Y.26
Cui, Q.27
Morokuma, K.28
Malick, D.K.29
Rabuck, A.D.30
Raghavachari, K.31
Foresman, J.B.32
Cioslowski, J.33
Ortiz, J.V.34
Babul, A.G.35
Stefanov, B.B.36
Liu, G.37
Liashenko, A.38
Piskorz, P.39
Komaromi, I.40
Gomperts, R.41
Martin, R.L.42
Fox, D.J.43
Keith, T.44
Al-Laham, M.A.45
Peng, C.Y.46
Nanayakkara, A.47
Challacombe, M.48
Gill, P.M.W.49
Johnson, B.50
Chen, W.51
Wong, M.W.52
Andres, J.L.53
Gonzalez, C.54
Head-Gordon, M.55
Replogle, E.S.56
Pople, J.A.57
more..
-
32
-
-
0001460584
-
-
Meyer, R., and Günthard, Hs. H., 1968, J. chem. Phys., 49, 1510.
-
(1968)
J. Chem. Phys.
, vol.49
, pp. 1510
-
-
Meyer, R.1
Günthard, Hs.H.2
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