-
3
-
-
5344232822
-
-
see also W. Kohn and L. J. Sham (Ref. 1);
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E. P. Wigner, Trans. Faraday Soc. 34, 678 (1938); see also W. Kohn and L. J. Sham (Ref. 1).
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Wigner, E.1
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7
-
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0001564460
-
-
Note, for instance, that LDA describes high-pressure phase transitions in (Formula presented) qualitatively incorrect in contrast to GGA as described in D. R. Hamann, Phys. Rev. Lett. 76, 660 (1996).
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Phys. Rev. Lett.
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Hamann, D.1
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11
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0001523738
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H. Zhong, Z. H. Levine, D. C. Allan and J. W. Wilkins, Phys. Rev. B 48, 1384 (1993).
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Phys. Rev. B
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Zhong, H.1
Levine, Z.2
Allan, D.3
Wilkins, J.4
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12
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33744678467
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P. Giannozzi, S. de Gironcoli, P. Pavone and S. Baroni, Phys. Rev. B 43, 7231 (1991), and references therein.
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Phys. Rev. B
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Giannozzi, P.1
de Gironcoli, S.2
Pavone, P.3
Baroni, S.4
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16
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-
84987141339
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For a review see Z. H. Levine, Int. J. Quantum Chem. S28, 411 (1994), and references therein.
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Int. J. Quantum Chem.
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Levine, Z.1
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24
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35949010303
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E. D. Palik, Handbook of Optical Constants of Solids II (Academic, Orlando, 1985), p. 691. For the quartz data see the following references: Y. Xu and W. Y. Ching, Phys. Rev. B 44, 11t048 (1991).
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Phys. Rev. B
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Palik, E.1
Ching, W.2
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26
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0038012690
-
-
cited in D. E. Gray, American Institute of Physics Handbook, 2nd ed. (McGraw-Hill, New York, 1963), pp. 6-26
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F. F. Martens, Ann. Phys. (Leipzig) 6, 603 (1901); cited in D. E. Gray, American Institute of Physics Handbook, 2nd ed. (McGraw-Hill, New York, 1963), pp. 6-26.
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Martens, F.1
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28
-
-
0000674467
-
-
the second of Ref. 30 (C); Ref. 24 (GaP); the first reference of Ref. 8 (Se, α-quartz);
-
The average values for Δ were obtained from: M. Rohlfing, P. Krüger and J. Pollmann, Phys. Rev. B 48, 17t791 (1993) (Si, Ge, GaAs); the second of Ref. 30 (C); Ref. 24 (GaP); the first reference of Ref. 8 (Se, α-quartz).
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Phys. Rev. B
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Rohlfing, M.1
Krüger, P.2
Pollmann, J.3
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29
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0000842204
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B. Wenzien, P. Käckell, F. Bechstedt and G. Cappellini, Phys. Rev. B 52, 10t897 (1995) (SiC).
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Phys. Rev. B
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Wenzien, B.1
Käckell, P.2
Bechstedt, F.3
Cappellini, G.4
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31
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0000630807
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A. Rubio, J. L. Corkill, M. L. Cohen, E. L. Shirley and S. G. Louie, Phys. Rev. B 48, 11t810 (1993) (AlN, GaN).
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Phys. Rev. B
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Rubio, A.1
Corkill, J.2
Cohen, M.3
Shirley, E.4
Louie, S.5
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32
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0000209506
-
-
S. B. Zhang, D. Tománek, M. L. Cohen, S. G. Louie and M. S. Hybertsen, Phys. Rev. B 40, 3162 (1989) (AlAs, same value chosen for AlP). We calculated the average band-gap values using special k points [H. J. Monkhorst and J. D. Pack, Phys. Rev. B 13, 5188 (1976)] and LDA band structures based on Troullier-Martins pseudopotentials [N. Troullier and J. L. Martins, Phys. Rev. B 43, 1993 (1991)].
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Phys. Rev. B
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Zhang, S.1
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Cohen, M.3
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Hybertsen, M.5
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