-
2
-
-
85037802565
-
-
note
-
For some problems the ""correct Hamiltonian" might be unknown. This is the case of relativistic many-particle computations, for example.
-
-
-
-
3
-
-
85037796166
-
-
I would like to thank Dr. Conroy for his kindness in making available his work prior to publication
-
H. Conroy. To be published in J. Chem. Phys. I would like to thank Dr. Conroy for his kindness in making available his work prior to publication.
-
J. Chem. Phys.
-
-
Conroy, H.1
-
4
-
-
85037791613
-
-
to be published
-
E. clementi, to be published.
-
-
-
Clementi, E.1
-
6
-
-
85037803356
-
-
note
-
l are the usual spherical harmonics.
-
-
-
-
7
-
-
85037794660
-
-
note
-
Supplement to the IBM Journal, this issue. (Available on request to the Editor).
-
-
-
-
9
-
-
0042977504
-
-
C. C. J. Roothaan, Rev. Mod. Phys. 23, 69 (1951); ibid., 32, 179 (1960);
-
(1960)
Rev. Mod. Phys.
, vol.32
, pp. 179
-
-
-
10
-
-
0003458728
-
-
Academic Press, Inc., New York
-
C. C. J. Roothaan and P. Bagus, Methods in Computational Physics, Vol. 2, Academic Press, Inc., New York, 1963.
-
(1963)
Methods in Computational Physics
, vol.2
-
-
Roothaan, C.C.J.1
Bagus, P.2
-
11
-
-
85037791701
-
-
note
-
∞v group for reason of generality in the examples given in Table 1.
-
-
-
-
12
-
-
85037789597
-
-
note
-
The time estimate is based on a computer program written at the University of Chicago for the Scientific Univac 1103A by A. D. McLean, M. Yoshimine and W. Weiss.
-
-
-
-
13
-
-
0003458728
-
-
Academic Press, Inc., N. Y.
-
See for example, I. Shavitt, Methods in Computational Physics, Vol. 2, Academic Press, Inc., N. Y., 1963, P. Barnett, ibid. ; F. Corbato and A. C. Switendick, ibid. Additional references can be obtained in the above quoted papers.
-
(1963)
Methods in Computational Physics
, vol.2
-
-
Shavitt, I.1
-
14
-
-
0342685124
-
-
See for example, I. Shavitt, Methods in Computational Physics, Vol. 2, Academic Press, Inc., N. Y., 1963, P. Barnett, ibid. ; F. Corbato and A. C. Switendick, ibid. Additional references can be obtained in the above quoted papers.
-
(1963)
Methods in Computational Physics
, vol.2
-
-
-
15
-
-
85037786754
-
-
Additional references can be obtained in the above quoted papers
-
See for example, I. Shavitt, Methods in Computational Physics, Vol. 2, Academic Press, Inc., N. Y., 1963, P. Barnett, ibid. ; F. Corbato and A. C. Switendick, ibid. Additional references can be obtained in the above quoted papers.
-
Methods in Computational Physics
-
-
Corbato, F.1
Switendick, A.C.2
-
17
-
-
0000567090
-
-
S. F. Boys, Proc. Roy. Soc. (London) A200, 542 (1950), ibid., A2S8, 402 (1960) . See in addition, F. E. Harris, Rev. Mod. Phys. 35, 558 (1963), and the recent work by M. Krauss, Journal of Research, N. B. S., 68B, 35 (1964). Additional references can be obtained from the last two quoted papers.
-
(1950)
Proc. Roy. Soc. (London)
, vol.A200
, pp. 542
-
-
Boys, S.F.1
-
18
-
-
4243261368
-
-
S. F. Boys, Proc. Roy. Soc. (London) A200, 542 (1950), ibid., A2S8, 402 (1960) . See in addition, F. E. Harris, Rev. Mod. Phys. 35, 558 (1963), and the recent work by M. Krauss, Journal of Research, N. B. S., 68B, 35 (1964). Additional references can be obtained from the last two quoted papers.
-
(1960)
Proc. Roy. Soc. (London)
, vol.A2S8
, pp. 402
-
-
-
19
-
-
0001195119
-
-
S. F. Boys, Proc. Roy. Soc. (London) A200, 542 (1950), ibid., A2S8, 402 (1960) . See in addition, F. E. Harris, Rev. Mod. Phys. 35, 558 (1963), and the recent work by M. Krauss, Journal of Research, N. B. S., 68B, 35 (1964). Additional references can be obtained from the last two quoted papers.
-
(1963)
Rev. Mod. Phys.
, vol.35
, pp. 558
-
-
Harris, F.E.1
-
20
-
-
0006389709
-
-
Additional references can be obtained from the last two quoted papers
-
S. F. Boys, Proc. Roy. Soc. (London) A200, 542 (1950), ibid., A2S8, 402 (1960) . See in addition, F. E. Harris, Rev. Mod. Phys. 35, 558 (1963), and the recent work by M. Krauss, Journal of Research, N. B. S., 68B, 35 (1964). Additional references can be obtained from the last two quoted papers.
-
(1964)
Journal of Research, N. B. S.
, vol.68 B
, pp. 35
-
-
Krauss, M.1
-
21
-
-
85037793045
-
SCF method in the paired-electron approximation
-
(to be published). IBM Technical Report. (Available on request)
-
S. Huzinaga, "SCF Method in the Paired-Electron Approximation," J. Chem. Phys. (to be published). IBM Technical Report. (Available on request).
-
J. Chem. Phys.
-
-
Huzinaga, S.1
-
24
-
-
36149005549
-
-
In this respect, see S. F. Boys, Rev. Mod. Phys. 32, 296 (1960).
-
(1960)
Rev. Mod. Phys.
, vol.32
, pp. 296
-
-
Boys, S.F.1
-
28
-
-
0343313339
-
-
E. Clementi, A. D. McLean, D. L. Raimondi, and M. Yoshimine, Phys. Rev. 133, A1274 (1964).
-
(1964)
Phys. Rev.
, vol.133
-
-
Clementi, E.1
McLean, A.D.2
Raimondi, D.L.3
Yoshimine, M.4
-
29
-
-
85037801390
-
III row negative ions
-
(in press)
-
E. clementi, "III Row Negative Ions," Phys. Rev. (in press).
-
Phys. Rev.
-
-
Clementi, E.1
-
30
-
-
85037794221
-
IBM technical reports RJ-283, February, 1964, RJ-287
-
February, 1964, in press July issue
-
E. clementi, IBM Technical Reports RJ-283, February, 1964, RJ-287, February, 1964, in press (J. Chem. Phys., July issue, 1964).
-
(1964)
J. Chem. Phys.
-
-
Clementi, E.1
-
31
-
-
0003728513
-
-
For work done prior to that given in this reference, see the bibliography in McGraw-Hill Book Co., N. Y.
-
For work done prior to that given in this reference, see the bibliography in J. C. Slater, Quantum Theory of Atomic Structures, Vol. 2, McGraw-Hill Book Co., N. Y., 1960.
-
(1960)
Quantum Theory of Atomic Structures
, vol.2
-
-
Slater, J.C.1
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34
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-
0003460783
-
-
McGraw-Hill Book Co., N. Y.
-
J. C. Slater, Electronic Structure of Molecules, McGraw-Hill Book Co., N. Y., 1963. R. G. Parr, The Quantum Theory of Molecular Electronic Structure, W. Benjamin, Inc., N. Y., 1963.
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(1963)
Electronic Structure of Molecules
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Slater, J.C.1
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35
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0004086603
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-
W. Benjamin, Inc., N. Y.
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J. C. Slater, Electronic Structure of Molecules, McGraw-Hill Book Co., N. Y., 1963. R. G. Parr, The Quantum Theory of Molecular Electronic Structure, W. Benjamin, Inc., N. Y., 1963.
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(1963)
The Quantum Theory of Molecular Electronic Structure
-
-
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36
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-
85037806258
-
-
Laboratory of Molecular Structure and Spectroscopy, Department of Physics, The University of Chicago, Technical Report No. 2, 1962-63.
-
Laboratory of Molecular Structure and Spectroscopy, Department of Physics, The University of Chicago, Technical Report No. 2, 1962-63.
-
-
-
-
37
-
-
0002587106
-
-
See for example, E. Clementi, J. Chem. Phys. 36, 33 (1962)., R. K. Nesbet, ibid., 36, 1518 (1962); A. D. McLean, ibid., 39, 2653 (1963).
-
(1962)
J. Chem. Phys.
, vol.36
, pp. 33
-
-
Clementi, E.1
-
38
-
-
0011685077
-
-
See for example, E. Clementi, J. Chem. Phys. 36, 33 (1962)., R. K. Nesbet, ibid., 36, 1518 (1962); A. D. McLean, ibid., 39, 2653 (1963).
-
(1962)
J. Chem. Phys.
, vol.36
, pp. 1518
-
-
Nesbet, R.K.1
-
39
-
-
0342685120
-
-
See for example, E. Clementi, J. Chem. Phys. 36, 33 (1962)., R. K. Nesbet, ibid., 36, 1518 (1962); A. D. McLean, ibid., 39, 2653 (1963).
-
(1963)
J. Chem. Phys.
, vol.39
, pp. 2653
-
-
McLean, A.D.1
-
40
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84913707215
-
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Ed., I. Prigogine, Interscience Publishers, N. Y.
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O. Sinanoglu, Advances in Chemical Physics, Ed., I. Prigogine, Interscience Publishers, N. Y., 1963, Vol. 6.
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(1963)
Advances in Chemical Physics
, vol.6
-
-
Sinanoglu, O.1
-
42
-
-
85037795796
-
-
See J. C. Slater (Ref. 18a).
-
See J. C. Slater (Ref. 18a).
-
-
-
-
43
-
-
0010853674
-
-
H. Hartmann and E. Clementi, Phys. Rev. 133, A1295 (1964). See also A. Fröman, Phys. Rev. 112, 870 (1958) and E. Clementi, J. Mol. Spectroscopy 12, 18 (1964).
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(1964)
Phys. Rev.
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-
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Hartmann, H.1
Clementi, E.2
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44
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4243664063
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H. Hartmann and E. Clementi, Phys. Rev. 133, A1295 (1964). See also A. Fröman, Phys. Rev. 112, 870 (1958) and E. Clementi, J. Mol. Spectroscopy 12, 18 (1964).
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Phys. Rev.
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, pp. 870
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Fröman, A.1
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45
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0011452113
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H. Hartmann and E. Clementi, Phys. Rev. 133, A1295 (1964). See also A. Fröman, Phys. Rev. 112, 870 (1958) and E. Clementi, J. Mol. Spectroscopy 12, 18 (1964).
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(1964)
J. Mol. Spectroscopy
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, pp. 18
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Clementi, E.1
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49
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0003556247
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O. J. Hirschfelder, C. F. Curtiss and R. B. Bird, Molecular Theory of Gases and Liquids, Wiley and Sons, Inc., N. Y., 1954.
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(1954)
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Hirschfelder, O.J.1
Curtiss, C.F.2
Bird, R.B.3
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50
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-
0007448064
-
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G. E. Brown, Phil. Mag., 43, 467 (1952). See also B. Swirles, Proc. Roy. Soc. A157, 680 (1936).
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(1952)
Phil. Mag.
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, pp. 467
-
-
Brown, G.E.1
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51
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0343991400
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G. E. Brown, Phil. Mag., 43, 467 (1952). See also B. Swirles, Proc. Roy. Soc. A157, 680 (1936).
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, vol.A157
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Swirles, B.1
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G. Breit, Phys. Rev. 34, 553 (1929); 35, 1447 (1930); 37, 51 (1931); 38, 463 (1931); 39, 616 (1932).
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G. Breit, Phys. Rev. 34, 553 (1929); 35, 1447 (1930); 37, 51 (1931); 38, 463 (1931); 39, 616 (1932).
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See for example, the review paper by P. O. Löwdin, Advances in Chemical Physics, Ed., I. Prigogine, Interscience Publisher, N. Y., 1959, Vol. 2.
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See for example, V. Ambegaokar, Astrophysics and The Many-Body Problem, W. A. Benjamin, Inc., N. Y., 1963; D. J. Thouless, The Quantum Mechanics of the Many-Body Systems, Academic Press, N. Y., 1961;
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See for example, V. Ambegaokar, Astrophysics and The Many-Body Problem, W. A. Benjamin, Inc., N. Y., 1963; D. J. Thouless, The Quantum Mechanics of the Many-Body Systems, Academic Press, N. Y., 1961;
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A. Fröman, Phys. Rev. 112, 870 (1958), Rev. Mod. Phys. 32, 317 (1960).
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36149019046
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H. P. Kelly, Phys. Rev. 131,684 (1963). This is an interesting and quite accurate computation on the Be('S) atom, where continuum eigenfunctions of the Hartree-Fock orbitals are explicitly used in a perturbation formalism of the type proposed by J. Goldstone, Proc. Roy. Soc. (London) A239, 267 (1957).
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Phys. Rev.
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, pp. 684
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Kelly, H.P.1
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36149019046
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This is an interesting and quite accurate computation on the Be('S) atom, where continuum eigenfunctions of the Hartree-Fock orbitals are explicitly used in a perturbation formalism of the type proposed by A239
-
H. P. Kelly, Phys. Rev. 131,684 (1963). This is an interesting and quite accurate computation on the Be('S) atom, where continuum eigenfunctions of the Hartree-Fock orbitals are explicitly used in a perturbation formalism of the type proposed by J. Goldstone, Proc. Roy. Soc. (London) A239, 267 (1957).
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Proc. Roy. Soc. (London)
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85037785980
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-
to be published Columbus, Ohio, June
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E. clementi, "Comprehensive Analysis of the First Three Periods of the Atomic System," to be published (presented at the Symposium of Molecular Structure and Spectra, Columbus, Ohio, June, 1963).
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(1963)
Symposium of Molecular Structure and Spectra
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Clementi, E.1
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76
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0011980751
-
-
The simple pairing model is exposed in detail by The model fails to sufficiently recognize the importance of Z dependency (Ref. 39) as well of the implication contained in the comments about excited states as reported in this work and elsewhere (Ref. 43). In this paper I use the term "simple pairing" model in the strict sense that there are two clearly distinguishable group of pairs, one strongly, the second weakly interacting.
-
The simple pairing model is exposed in detail by L. C. Allen, E. clementi, and H. Gladney, Rev. Mod. Phys. 35, 465 (1963). The model fails to sufficiently recognize the importance of Z dependency (Ref. 39) as well of the implication contained in the comments about excited states as reported in this work and elsewhere (Ref. 43). In this paper I use the term "simple pairing" model in the strict sense that there are two clearly distinguishable group of pairs, one strongly, the second weakly interacting.
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Rev. Mod. Phys.
, vol.35
, pp. 465
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Allen, L.C.1
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88
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85037794034
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Phys. Rev..
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Yoshimine, M.1
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|