-
3
-
-
37049142108
-
-
D. E. McKee, C. J. Adams, A. Zalkin, N. Bartlett, J. Chem. Soc. Chem. Commun. 1973, 26.
-
(1973)
J. Chem. Soc. Chem. Commun.
, pp. 26
-
-
McKee, D.E.1
Adams, C.J.2
Zalkin, A.3
Bartlett, N.4
-
6
-
-
0000312750
-
-
c) K. O. Christe, W. W. Wilson, R. D. Wilson, Inorg. Chem. 1984, 23, 2058;
-
(1984)
Inorg. Chem.
, vol.23
, pp. 2058
-
-
Christe, K.O.1
Wilson, W.W.2
Wilson, R.D.3
-
7
-
-
0001472815
-
-
d) K. O. Christe, R. D. Wilson, W. W. Wilson, R. Bau, S. Sukumar, D. A. Dixon, J. Am. Chem. Soc. 1991, 113, 3795.
-
(1991)
J. Am. Chem. Soc.
, vol.113
, pp. 3795
-
-
Christe, K.O.1
Wilson, R.D.2
Wilson, W.W.3
Bau, R.4
Sukumar, S.5
Dixon, D.A.6
-
11
-
-
0000001948
-
-
a) V. B. Sokolov, Y. V. Dobrychevskii, V. N. Prusakov, A. V. Ryzhkov, S. S. Koroshev, Dokl. Akad. Nauk SSSR 1976, 229, 641;
-
(1976)
Dokl. Akad. Nauk SSSR
, vol.229
, pp. 641
-
-
Sokolov, V.B.1
Dobrychevskii, Y.V.2
Prusakov, V.N.3
Ryzhkov, A.V.4
Koroshev, S.S.5
-
14
-
-
0007850649
-
-
b) R. Minkwitz, G. Nowicki, Angew. Chem. 1990, 102, 692; Angew. Chem. Int. Ed. Engl. 1990, 29, 688;
-
(1990)
Angew. Chem.
, vol.102
, pp. 692
-
-
Minkwitz, R.1
Nowicki, G.2
-
15
-
-
33748237528
-
-
b) R. Minkwitz, G. Nowicki, Angew. Chem. 1990, 102, 692; Angew. Chem. Int. Ed. Engl. 1990, 29, 688;
-
(1990)
Angew. Chem. Int. Ed. Engl.
, vol.29
, pp. 688
-
-
-
18
-
-
0000455717
-
-
and references therein
-
e) R. Minkwitz, G. Nowicki, B. Back, W. Sawodny, Inorg. Chem. 1993, 32, 787, and references therein.
-
(1993)
Inorg. Chem.
, vol.32
, pp. 787
-
-
Minkwitz, R.1
Nowicki, G.2
Back, B.3
Sawodny, W.4
-
19
-
-
0001612891
-
-
and references therein
-
F. Grandinetti, F. Pepi, A. Ricci, Chem. Eur. J. 1996, 2, 495, and references therein.
-
(1996)
Chem. Eur. J.
, vol.2
, pp. 495
-
-
Grandinetti, F.1
Pepi, F.2
Ricci, A.3
-
20
-
-
0030731052
-
-
and references therein
-
R. Cipollini, M. E. Crestoni, S. Fornarini, J. Am. Chem. Soc. 1997, 119, 9499, and references therein.
-
(1997)
J. Am. Chem. Soc.
, vol.119
, pp. 9499
-
-
Cipollini, R.1
Crestoni, M.E.2
Fornarini, S.3
-
21
-
-
0000433543
-
-
a) A. Fiedler, D. Schröder, W. Zummack, H. Schwarz, Inorg. Chim. Acta 1997, 259, 227;
-
(1997)
Inorg. Chim. Acta
, vol.259
, pp. 227
-
-
Fiedler, A.1
Schröder, D.2
Zummack, W.3
Schwarz, H.4
-
22
-
-
3743106130
-
-
b) G. A. Janaway, M. Zhong, G. G. Gatev, M. L. Chabinyc, J. Brauman, J. Am. Chem. Soc. 1998, 48, 11 697;
-
(1998)
J. Am. Chem. Soc.
, vol.48
, Issue.11
, pp. 697
-
-
Janaway, G.A.1
Zhong, M.2
Gatev, G.G.3
Chabinyc, M.L.4
Brauman, J.5
-
23
-
-
0007748673
-
-
c) J. Hu, B. T. Hill, R. R. Squires, J. Am. Chem. Soc. 1998, 48, 11699:
-
(1998)
J. Am. Chem. Soc.
, vol.48
, pp. 11699
-
-
Hu, J.1
Hill, B.T.2
Squires, R.R.3
-
24
-
-
0007743993
-
-
d) M. Aschi, J. N. Harvey, C. Schalley, D. Schröder, H. Schwarz, J. Chem. Soc. Chem. Commun. 1998, 531.
-
(1998)
J. Chem. Soc. Chem. Commun.
, pp. 531
-
-
Aschi, M.1
Harvey, J.N.2
Schalley, C.3
Schröder, D.4
Schwarz, H.5
-
25
-
-
0003007186
-
-
Ed.: W. F. Drake, Gordon, AIP Press, Woodbury, New York, and references therein
-
a) D. R. Yarkony in Atomic, Molecular and Optical Physics Handbook (Ed.: W. F. Drake, Gordon), AIP Press, Woodbury, New York, 1996, p. 357, and references therein;
-
(1996)
Atomic, Molecular and Optical Physics Handbook
, pp. 357
-
-
Yarkony, D.R.1
-
26
-
-
3743077263
-
-
in ref. [12a], and references therein
-
b) E. E. Nikitin in ref. [12a], p. 561, and references therein;
-
-
-
Nikitin, E.E.1
-
27
-
-
0005510091
-
-
Eds.: T. Baer, C. Y. Ng, I. Powis, Wiley, New York
-
c) J. C. Lorquet in The Structure, Energetics and Dynamics of Organic Ions (Eds.: T. Baer, C. Y. Ng, I. Powis), Wiley, New York, 1996;
-
(1996)
The Structure, Energetics and Dynamics of Organic Ions
-
-
Lorquet, J.C.1
-
29
-
-
0031979212
-
-
and references therein
-
e) S. Shaik, M. Filatov, D. Schröder, H. Schwarz, Chem. Eur. J. 1998, 4, 193, and references therein;
-
(1998)
Chem. Eur. J.
, vol.4
, pp. 193
-
-
Shaik, S.1
Filatov, M.2
Schröder, D.3
Schwarz, H.4
-
30
-
-
0001347770
-
-
f) J. E. Stevens, Q. Cui, K. Morokuma, J. Chem. Phys. 1998, 108, 1544.
-
(1998)
J. Chem. Phys.
, vol.108
, pp. 1544
-
-
Stevens, J.E.1
Cui, Q.2
Morokuma, K.3
-
31
-
-
0000111737
-
-
a) F. Grandinetti, J. Hrusàk, D. Schröder, S. Karrass, H. Schwarz, J. Am. Chem. Soc. 1992, 114, 2806;
-
(1992)
J. Am. Chem. Soc.
, vol.114
, pp. 2806
-
-
Grandinetti, F.1
Hrusàk, J.2
Schröder, D.3
Karrass, S.4
Schwarz, H.5
-
32
-
-
0007803202
-
-
b) F. Cacace, F. Grandinetti, F. Pepi. Angew. Chem. 1994, 106, 104; Angew. Chem. Int. Ed. Engl. 1994, 33, 123;
-
(1994)
Angew. Chem.
, vol.106
, pp. 104
-
-
Cacace, F.1
Grandinetti, F.2
Pepi, F.3
-
33
-
-
33748229987
-
-
b) F. Cacace, F. Grandinetti, F. Pepi. Angew. Chem. 1994, 106, 104; Angew. Chem. Int. Ed. Engl. 1994, 33, 123;
-
(1994)
Angew. Chem. Int. Ed. Engl.
, vol.33
, pp. 123
-
-
-
34
-
-
0000345745
-
-
c) M. Aschi, F. Grandinetti, F. Pepi, Int. J. Mass Spectrom. Ion Processes 1994, 130, 117;
-
(1994)
Int. J. Mass Spectrom. Ion Processes
, vol.130
, pp. 117
-
-
Aschi, M.1
Grandinetti, F.2
Pepi, F.3
-
35
-
-
33751158056
-
-
d) M. Aschi, F. Cacace, F. Grandinetti, F. Pepi, J. Phys. Chem. 1994, 98, 2713;
-
(1994)
J. Phys. Chem.
, vol.98
, pp. 2713
-
-
Aschi, M.1
Cacace, F.2
Grandinetti, F.3
Pepi, F.4
-
36
-
-
0000589630
-
-
e) F. Cacace, F. Grandinetti, F. Pepi, J. Phys. Chem. 1994, 98, 8009;
-
(1994)
J. Phys. Chem.
, vol.98
, pp. 8009
-
-
Cacace, F.1
Grandinetti, F.2
Pepi, F.3
-
38
-
-
0000461515
-
-
g) F. Cacace, F. Grandinetti, F. Pepi, Inorg. Chem. 1995, 34, 1325;
-
(1995)
Inorg. Chem.
, vol.34
, pp. 1325
-
-
Cacace, F.1
Grandinetti, F.2
Pepi, F.3
-
39
-
-
0031587576
-
-
h) F. Grandinetti, P. Cecchi, V. Vinciguerra, Chem. Phys. Lett. 1997, 281, 431.
-
(1997)
Chem. Phys. Lett.
, vol.281
, pp. 431
-
-
Grandinetti, F.1
Cecchi, P.2
Vinciguerra, V.3
-
42
-
-
0001162555
-
-
b) V. Tarnovsky, A. Levin, K. Becker, R. Basner, M. Schmidt, Int. J. Mass Spectrom. Ion Processes 1994, 133, 175.
-
(1994)
Int. J. Mass Spectrom. Ion Processes
, vol.133
, pp. 175
-
-
Tarnovsky, V.1
Levin, A.2
Becker, K.3
Basner, R.4
Schmidt, M.5
-
44
-
-
3743052561
-
-
Unless stated otherwise, all experimental thermochemical data are taken from S. G. Lias, J. A. Bartmess, J. F. Liebman, J. L. Holmes, R. D. Levin, W. G. Mallard, J. Phys. Chem. Ref. Data 1988, 17, Suppl. 1.
-
(1988)
J. Phys. Chem. Ref. Data
, vol.17
, Issue.SUPPL. 1
-
-
Lias, S.G.1
Bartmess, J.A.2
Liebman, J.F.3
Holmes, J.L.4
Levin, R.D.5
Mallard, W.G.6
-
45
-
-
0041401966
-
-
L. A. Curtiss, K. Raghavachari, G. W. Trucks, J. A. Pople, J. Chem. Phys. 1991, 94, 7221.
-
(1991)
J. Chem. Phys.
, vol.94
, pp. 7221
-
-
Curtiss, L.A.1
Raghavachari, K.2
Trucks, G.W.3
Pople, J.A.4
-
46
-
-
0031560545
-
-
a) R. D. J. Froese, S. Humbel, M. Svensson, K. Morokuma, J Phys. Chem. 1997, 101, 227;
-
(1997)
J Phys. Chem.
, vol.101
, pp. 227
-
-
Froese, R.D.J.1
Humbel, S.2
Svensson, M.3
Morokuma, K.4
-
47
-
-
36449008175
-
-
b) A. M. Mebel, K. Morokuma, M. C. Lin, J. Chem. Phys. 1995, 103, 7414.
-
(1995)
J. Chem. Phys.
, vol.103
, pp. 7414
-
-
Mebel, A.M.1
Morokuma, K.2
Lin, M.C.3
-
50
-
-
0009496633
-
-
a) A. B. Cornford, D. C. Frost, F. G. Herring, C. A. McDowell, J. Chem. Phys. 1971, 54, 1872;
-
(1971)
J. Chem. Phys.
, vol.54
, pp. 1872
-
-
Cornford, A.B.1
Frost, D.C.2
Herring, F.G.3
McDowell, C.A.4
-
51
-
-
0012714330
-
-
b) A. B. Cornford, D. C. Frost, F. G. Herring, C. A. McDowell, J. Chem. Soc. Faraday Discuss. 1972, 54, 56.
-
(1972)
J. Chem. Soc. Faraday Discuss.
, vol.54
, pp. 56
-
-
Cornford, A.B.1
Frost, D.C.2
Herring, F.G.3
McDowell, C.A.4
-
52
-
-
0029637658
-
-
T. J. Buckley, R. D. Johnson III, R. E. Huie, Z. Zhang, S. C. Kuo, R. B. Klemm, J. Phys. Chem. 1995, 99, 4879.
-
(1995)
J. Phys. Chem.
, vol.99
, pp. 4879
-
-
Buckley, T.J.1
Johnson III, R.D.2
Huie, R.E.3
Zhang, Z.4
Kuo, S.C.5
Klemm, R.B.6
-
53
-
-
0000276193
-
-
and references therein
-
S. S. Xantheas, T. H. Dunning, Jr., A. Mavridis, J. Chem. Phys. 1997, 106, 3280, and references therein.
-
(1997)
J. Chem. Phys.
, vol.106
, pp. 3280
-
-
Xantheas, S.S.1
Dunning Jr., T.H.2
Mavridis, A.3
-
55
-
-
4444220941
-
-
R. P. Morgan, J. H. Beynon, R. H. Bateman, B. N. Green, Int. J. Mass Spectrom. Ion Processes 1978, 28, 171.
-
(1978)
Int. J. Mass Spectrom. Ion Processes
, vol.28
, pp. 171
-
-
Morgan, R.P.1
Beynon, J.H.2
Bateman, R.H.3
Green, B.N.4
-
56
-
-
0003431514
-
-
Ed.: R. G. Cooks, Plenum, New York
-
a) Collision Spectroscopy (Ed.: R. G. Cooks), Plenum, New York, 1978;
-
(1978)
Collision Spectroscopy
-
-
-
57
-
-
0009094662
-
-
b) K. Levsen, H. Schwarz, Angew. Chem. 1976, 55, 589; Angew. Chem. Int. Ed. Engl. 1976, 15, 509;
-
(1976)
Angew. Chem.
, vol.55
, pp. 589
-
-
Levsen, K.1
Schwarz, H.2
-
58
-
-
84980134608
-
-
b) K. Levsen, H. Schwarz, Angew. Chem. 1976, 55, 589; Angew. Chem. Int. Ed. Engl. 1976, 15, 509;
-
(1976)
Angew. Chem. Int. Ed. Engl.
, vol.15
, pp. 509
-
-
-
61
-
-
0004024840
-
-
Elsevier, Amsterdam
-
R. G. Cooks, J. H. Beynon, R. M. Caprioli, G. R. Lester, Metastable Ions, Elsevier, Amsterdam, 1973.
-
(1973)
Metastable Ions
-
-
Cooks, R.G.1
Beynon, J.H.2
Caprioli, R.M.3
Lester, G.R.4
-
64
-
-
3743131948
-
-
c) R. D. Bowen, D. H. Williams, H. Schwarz, Angew. Chem. 1979, 91, 484; Angew. Chem. Int. Ed Engl. 1979, 18, 451.
-
(1979)
Angew. Chem.
, vol.91
, pp. 484
-
-
Bowen, R.D.1
Williams, D.H.2
Schwarz, H.3
-
65
-
-
0018479740
-
-
c) R. D. Bowen, D. H. Williams, H. Schwarz, Angew. Chem. 1979, 91, 484; Angew. Chem. Int. Ed Engl. 1979, 18, 451.
-
(1979)
Angew. Chem. Int. Ed Engl.
, vol.18
, pp. 451
-
-
-
66
-
-
3743137371
-
-
note
-
We assume that the uncertainty in the entropy term is negligible with respect to the enthalpy term.
-
-
-
-
67
-
-
0000746816
-
-
a) A. M. Ferrari, P. Ugliengo, E. Garrone, J. Chem. Phys. 1996, 105, 4129;
-
(1996)
J. Chem. Phys.
, vol.105
, pp. 4129
-
-
Ferrari, A.M.1
Ugliengo, P.2
Garrone, E.3
-
68
-
-
0031553346
-
-
b) A. J. Lupinetti, S. Fau, G. Frenking, S. H. Strauss, J. Phys. Chem. A 1997, 101, 9551.
-
(1997)
J. Phys. Chem. A
, vol.101
, pp. 9551
-
-
Lupinetti, A.J.1
Fau, S.2
Frenking, G.3
Strauss, S.H.4
-
69
-
-
3743093846
-
-
note
-
All the sationary points with connectivity similar to 4S located on the triplet B3LYP/6-31G(d) PES proved to be second-order saddle points, even when the larger 6-311 + G(d) basis set was used.
-
-
-
-
70
-
-
0141826760
-
-
a) J. I. Brauman, C. A. Lieder, M. J. White, J. Am. Chem. Soc. 1973, 95, 927;
-
(1973)
J. Am. Chem. Soc.
, vol.95
, pp. 927
-
-
Brauman, J.I.1
Lieder, C.A.2
White, M.J.3
-
75
-
-
5244231184
-
-
See, for example, a) D. R. Yarkony, J. Phys. Chem. 1993, 97, 4407; b) M. J. Bearpark, M. A. Robb, H. B. Schlegel, Chem. Phys. Lett. 1994, 223, 269; c) C. Quiang, K. Morokuma, Chem. Phys. Lett. 1996, 263, 54.
-
(1993)
J. Phys. Chem.
, vol.97
, pp. 4407
-
-
Yarkony, D.R.1
-
76
-
-
43949151212
-
-
See, for example, a) D. R. Yarkony, J. Phys. Chem. 1993, 97, 4407; b) M. J. Bearpark, M. A. Robb, H. B. Schlegel, Chem. Phys. Lett. 1994, 223, 269; c) C. Quiang, K. Morokuma, Chem. Phys. Lett. 1996, 263, 54.
-
(1994)
Chem. Phys. Lett.
, vol.223
, pp. 269
-
-
Bearpark, M.J.1
Robb, M.A.2
Schlegel, H.B.3
-
77
-
-
0030573149
-
-
See, for example, a) D. R. Yarkony, J. Phys. Chem. 1993, 97, 4407; b) M. J. Bearpark, M. A. Robb, H. B. Schlegel, Chem. Phys. Lett. 1994, 223, 269; c) C. Quiang, K. Morokuma, Chem. Phys. Lett. 1996, 263, 54.
-
(1996)
Chem. Phys. Lett.
, vol.263
, pp. 54
-
-
Quiang, C.1
Morokuma, K.2
-
79
-
-
3743079492
-
-
note
-
The absolute energies and corrections for the evaluation of the G2MS energies of TSS are as follows (in Hartree): CCSD(T)/6-31G(d) = -366.30769, Δ(MP2) = -0.37661, HLC = -0.08358. ZPE = 0.01561, G2MS (0 K) = -366.75227, G2MS (298.15 K) = -366.74805.
-
-
-
-
82
-
-
0007701276
-
-
b) M. Charpentier, J. Fossey, T. T. Tidwell, S. Wolfe, Can. J. Chem. 1987, 65, 473;
-
(1987)
Can. J. Chem.
, vol.65
, pp. 473
-
-
Charpentier, M.1
Fossey, J.2
Tidwell, T.T.3
Wolfe, S.4
-
83
-
-
0001345417
-
-
c) N. E. Takenaka, R. Hamlin, D. M. Lemal, J. Am. Chem. Soc. 1990, 112, 6715;
-
(1990)
J. Am. Chem. Soc.
, vol.112
, pp. 6715
-
-
Takenaka, N.E.1
Hamlin, R.2
Lemal, D.M.3
-
84
-
-
0000888469
-
-
d) M. McAllister, T. T. Tidwell, M. R. Peterson, I. G. Csizmadia, J. Org. Chem. 1991, 56, 575;
-
(1991)
J. Org. Chem.
, vol.56
, pp. 575
-
-
McAllister, M.1
Tidwell, T.T.2
Peterson, M.R.3
Csizmadia, I.G.4
-
85
-
-
84989135130
-
-
e) S. Tajima, S. Tobita, M. Mitani, K. Akuzawa, H. Sawada, M. Nakayama, Org. Mass Spectrom. 1991, 26, 1023.
-
(1991)
Org. Mass Spectrom.
, vol.26
, pp. 1023
-
-
Tajima, S.1
Tobita, S.2
Mitani, M.3
Akuzawa, K.4
Sawada, H.5
Nakayama, M.6
-
88
-
-
0004133516
-
-
Gaussian, Pittsburgh PA
-
Gaussian 94, Revision E.1. M. J. Frisch, G. W. Trucks, H. B. Schlegel, P. M. W. Gill. B. G. Johnson, M. A. Robb, J. R. Cheeseman, T. A. Keith, G. A. Petersson, J. A. Montgomery, K. Raghavachari, M. A. Al-Laham, V. G. Zakrzewski, J. V. Ortiz, J. B. Foresman, J. Cioslowski, B. B. Stefanov, A. Nanayakkara, M. Challacombe, C. Y. Peng, P. Y. Ayala, W. Chen, M. W. Wong, J. L. Andres, E. S. Replogle, R. Gomperts, R. L. Martin, D. J. Fox, J. S. Binkley, D. J. Defrees, J. Baker, J. P. Stewart, M. Head-Gordon, C. Gonzalez, J. A. Pople, Gaussian, Pittsburgh PA, 1995.
-
(1995)
Gaussian 94, Revision E.1
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
Gill, P.M.W.4
Johnson, B.G.5
Robb, M.A.6
Cheeseman, J.R.7
Keith, T.A.8
Petersson, G.A.9
Montgomery, J.A.10
Raghavachari, K.11
Al-Laham, M.A.12
Zakrzewski, V.G.13
Ortiz, J.V.14
Foresman, J.B.15
Cioslowski, J.16
Stefanov, B.B.17
Nanayakkara, A.18
Challacombe, M.19
Peng, C.Y.20
Ayala, P.Y.21
Chen, W.22
Wong, M.W.23
Andres, J.L.24
Replogle, E.S.25
Gomperts, R.26
Martin, R.L.27
Fox, D.J.28
Binkley, J.S.29
Defrees, D.J.30
Baker, J.31
Stewart, J.P.32
Head-Gordon, M.33
Gonzalez, C.34
Pople, J.A.35
more..
-
90
-
-
33751157732
-
-
b) P. J. Stephens, F. J. Devlin, C. F. Chabalowski, M. J. Frisch, J. Phys. Chem. 1994, 98, 11623;
-
(1994)
J. Phys. Chem.
, vol.98
, pp. 11623
-
-
Stephens, P.J.1
Devlin, F.J.2
Chabalowski, C.F.3
Frisch, M.J.4
-
92
-
-
36849115659
-
-
a) R. Ditchfield, W. J. Hehre, J. A. Pople, J. Chem. Phys. 1971, 54, 724;
-
(1971)
J. Chem. Phys.
, vol.54
, pp. 724
-
-
Ditchfield, R.1
Hehre, W.J.2
Pople, J.A.3
-
93
-
-
0347170005
-
-
b) W. J. Hehre, R. Ditchfield, J. A. Pople, J. Chem. Phys. 1972, 56, 2257;
-
(1972)
J. Chem. Phys.
, vol.56
, pp. 2257
-
-
Hehre, W.J.1
Ditchfield, R.2
Pople, J.A.3
-
97
-
-
0006244148
-
-
K. Raghavachari, G. W. Trucks, J. A. Pople, M. Head-Gordon, Chem. Phys. Lett. 1989, 157, 479.
-
(1989)
Chem. Phys. Lett.
, vol.157
, pp. 479
-
-
Raghavachari, K.1
Trucks, G.W.2
Pople, J.A.3
Head-Gordon, M.4
-
99
-
-
26844534384
-
-
a) R. Krishnan, J. S. Binkley, R. Seeger, J. A. Pople, J. Chem. Phys. 1980, 72, 650;
-
(1980)
J. Chem. Phys.
, vol.72
, pp. 650
-
-
Krishnan, R.1
Binkley, J.S.2
Seeger, R.3
Pople, J.A.4
-
100
-
-
84986468715
-
-
b) T. Clark, J. Chandrasekhar, G. W. Spitznagel, P. von R. Schleyer, J. Comput. Chem. 1983, 4, 294;
-
(1983)
J. Comput. Chem.
, vol.4
, pp. 294
-
-
Clark, T.1
Chandrasekhar, J.2
Spitznagel, G.W.3
Von Schleyer, P.R.4
-
101
-
-
36549091139
-
-
b) M. J. Frish, J. A. Pople, J. S. Binkley, J. Chem. Phys. 1984, 80, 3265.
-
(1984)
J. Chem. Phys.
, vol.80
, pp. 3265
-
-
Frish, M.J.1
Pople, J.A.2
Binkley, J.S.3
-
105
-
-
36749120357
-
-
W. H. Miller, N. C. Handy, J. E. Adams, J. Chem. Phys. 1980, 72, 99.
-
(1980)
J. Chem. Phys.
, vol.72
, pp. 99
-
-
Miller, W.H.1
Handy, N.C.2
Adams, J.E.3
-
107
-
-
24644462005
-
-
S. Koseki, M. S. Gordon, M. W. Schmidt, N. Matsunaga, J. Phys. Chem. 1995, 99, 12764.
-
(1995)
J. Phys. Chem.
, vol.99
, pp. 12764
-
-
Koseki, S.1
Gordon, M.S.2
Schmidt, M.W.3
Matsunaga, N.4
-
108
-
-
0001298982
-
-
S. Koseki, M. W. Schmidt, M. S. Gordon, J. Phys. Chem. 1992, 96, 10768.
-
(1992)
J. Phys. Chem.
, vol.96
, pp. 10768
-
-
Koseki, S.1
Schmidt, M.W.2
Gordon, M.S.3
-
109
-
-
84893169025
-
-
M. W. Schmidt, K. K. Baldridge, J. A. Boatz, S. T. Elbert, M. S. Gordon, J. H. Jensen, S. Koseki, N. Matsunaga, K. A. Nguyen, S. J. Su, T. L. Windus, M. Dupuis, J. A. Montgomery, J. Comput. Chem. 1993, 14, 1347.
-
(1993)
J. Comput. Chem.
, vol.14
, pp. 1347
-
-
Schmidt, M.W.1
Baldridge, K.K.2
Boatz, J.A.3
Elbert, S.T.4
Gordon, M.S.5
Jensen, J.H.6
Koseki, S.7
Matsunaga, N.8
Nguyen, K.A.9
Su, S.J.10
Windus, T.L.11
Dupuis, M.12
Montgomery, J.A.13
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