-
1
-
-
17444425574
-
-
Gaydon, A. G., and Pearse, R. W. B., 1935, Proc. R. Soc. A, 148, 312.
-
(1935)
Proc. R. Soc. A.
, vol.148
, pp. 312
-
-
Gaydon, A.G.1
Pearse, R.W.B.2
-
2
-
-
84946465057
-
-
Thesis, Stockholm
-
Heimer, A., 1937, Thesis, Stockholm
-
(1937)
-
-
Heimer, A.1
-
3
-
-
17444409174
-
-
Heimer, A., 1937, Z. Phys., 105, 56.
-
(1937)
Z. Phys.
, vol.105
, pp. 56
-
-
Heimer, A.1
-
4
-
-
17444393826
-
-
Åslund, N., Neuhaus, H., Lagerqvist, A., and Andersen, E., 1965, Ark. Fys., 28, 271.
-
(1965)
Ark. Fys.
, vol.28
, pp. 271
-
-
Åslund, N.1
Neuhaus, H.2
Lagerqvist, A.3
Andersen, E.4
-
5
-
-
84946446891
-
-
Wright, R. B., Bates, J. K., and Gruen, D. M., 1980, Inorg. Chem., 17, 525.
-
(1980)
Inorg. Chem.
, vol.17
, pp. 525
-
-
Wright, R.B.1
Bates, J.K.2
Gruen, D.M.3
-
6
-
-
4243165255
-
-
1981 (private communication)
-
Scullman, R., Löfgren, S., and Adakkai Kadavathu, S., 1982, Physica scripta, 25, 295; 1981 (private communication).
-
(1982)
Physica Scripta.
, vol.25
, pp. 295
-
-
Scullman, R.1
Löfgren, S.2
Adakkai Kadavathu, S.3
-
7
-
-
0042445574
-
-
Bagus, P. S., and Bjorkman, C, 1981, Phys. Rev. A, 23, 461.
-
(1981)
Phys. Rev. A.
, vol.23
, pp. 461
-
-
Bagus, P.S.1
Bjorkman, C.2
-
8
-
-
0011452052
-
-
Melius, C. F., Moskowitz, J. W., Mortola, A. P., Baillie, M. B., and Ratner, M. A., 1976, Surf. Sci., 59, 279.
-
(1976)
Surf. Sci.
, vol.59
, pp. 279
-
-
Melius, C.F.1
Moskowitz, J.W.2
Mortola, A.P.3
Baillie, M.B.4
Ratner, M.A.5
-
9
-
-
0016903651
-
-
Goddard, W. A. III., Walch, S. P., Rappe, A. K., Upton, T. H., and Melius, C. F., 1977, J. Vac. Sci. TechnoL, 14,416.
-
(1977)
J. Vac. Sci. Technol.
, vol.14
, pp. 416
-
-
Goddard, W.A.1
Walch, S.P.2
Rappe, A.K.3
Upton, T.H.4
Melius, C.F.5
-
10
-
-
84987110426
-
-
Guse, M. P., Blint, R. J., and Kunz, A. B., 1977, Int. J. quant. Chem., 11, 725.
-
(1977)
Int. J. Quant. Chem.
, vol.11
, pp. 725
-
-
Guse, M.P.1
Blint, R.J.2
Kunz, A.B.3
-
11
-
-
84913399663
-
-
Dunlap, B. I., and Yu, H. L., 1980, Chem. Phys. Lett., 73, 525.
-
(1980)
Chem. Phys. Lett.
, vol.73
, pp. 525
-
-
Dunlap, B.I.1
Yu, H.L.2
-
13
-
-
84946465058
-
-
private communication
-
Martin, R. (private communication).
-
-
-
Martin, R.1
-
14
-
-
84957154356
-
-
Siegbahn, P. E. M., Heiberg, A., Roos, B. O., and Levy, B., 1980, Physica scripta, 21, 323.
-
(1980)
Physica Scripta.
, vol.21
, pp. 323
-
-
Siegbahn, P.E.M.1
Heiberg, A.2
Roos, B.O.3
Levy, B.4
-
15
-
-
0001177596
-
-
Roos, B. O., Taylor, P. R., and Siegbahn, P. E. M., 1980, Chem. Phys., 48, 157.
-
(1980)
Chem. Phys.
, vol.48
, pp. 157
-
-
Roos, B.O.1
Taylor, P.R.2
Siegbahn, P.E.M.3
-
16
-
-
34250699732
-
-
Siegbahn, P. E. M., Almlof, J., Heiberg, A., and Roos, B. O., 1981, J. chem. Phys., 74, 2384.
-
(1981)
J. Chem. Phys.
, vol.74
, pp. 2384
-
-
Siegbahn, P.E.M.1
Almlof, J.2
Heiberg, A.3
Roos, B.O.4
-
20
-
-
0347461898
-
-
Bauschlicher, C. W. Jr., and Walch, S. P., 1981, J. chem. Phys., 74, 5922.
-
(1981)
J. Chem. Phys.
, vol.74
, pp. 5922
-
-
Bauschlicher, C.W.1
Walch, S.P.2
-
21
-
-
0000994840
-
-
Bauschlicher, C. W. Jr., Walch, S. P., and Partridge, H., 1982, J. chem. Phys., 76, 1033.
-
(1982)
J. Chem. Phys.
, vol.76
, pp. 1033
-
-
Bauschlicher, C.W.1
Walch, S.P.2
Partridge, H.3
-
23
-
-
0001110004
-
-
Martin, R. L., and Hay, P. J., 1981, J. chem. Phys., 75, 4539.
-
(1981)
J. Chem. Phys.
, vol.75
, pp. 4539
-
-
Martin, R.L.1
Hay, P.J.2
-
24
-
-
0000061641
-
-
Botch, B. H., Dunning, T. H. Jr., and Harrison, J. F., 1981, J. chem. Phys., 75, 3466.
-
(1981)
J. Chem. Phys.
, vol.75
, pp. 3466
-
-
Botch, B.H.1
Dunning, T.H.2
Harrison, J.F.3
-
27
-
-
0344130631
-
-
Roos, B., Veillard, A., and Vinot, G., 1971, Theor. chim. Acta, 20, 1.
-
(1971)
Theor. Chim. Acta.
, vol.20
, pp. 1
-
-
Roos, B.1
Veillard, A.2
Vinot, G.3
-
28
-
-
84946465061
-
-
(private communication)
-
Karwowski, J. (private communication).
-
-
-
Karwowski, J.1
-
30
-
-
84946465062
-
-
x- and, y, -orbitals and, x, 2, -y, 2, - and Szy-orbitals, respectively
-
For technical reasons the calculations were performed in C2v symmetry instead of the full linear symmetry, C∞v Therefore the doubly degenerate - and -orbitals are divided into x- and y-orbitals and x2-y2- and Szy-orbitals, respectively.
-
-
-
-
32
-
-
36749120218
-
-
Tatewaki, H., and Huzinaga, S., 1979, J. chem. Phys., 71, 4339.
-
(1979)
J. Chem. Phys.
, vol.71
, pp. 4339
-
-
Tatewaki, H.1
Huzinaga, S.2
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