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Volumn 112, Issue 11, 2000, Pages 5158-5167

Accurate ab initio determination of magnetic interactions and hopping integrals in La2-xSrxCuO4 systems

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EID: 0000712794     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.481093     Document Type: Article
Times cited : (98)

References (81)
  • 3
    • 0003415558 scopus 로고
    • edited by E. Schachinger, H. Mitter, and H. Sormann (Plenum, New York)
    • See for instance, E. Dagotto, in Recent Progress in Many-Body Theories, edited by E. Schachinger, H. Mitter, and H. Sormann (Plenum, New York, 1995), Vol. 4; in High Temperature Superconductivity, edited by K. Bedell, D. Coffey, D. Meltzer, D. Pines, and J. R. Shrieffer (Addison-Wesley, New York, 1990); in Superconductivity, edited by J. G. Bednorz and K. A. Müller, Springer Series in Solid Stale Science (Springer, Berlin, 1990), Vol. 90; in Electronic Properties of High-Tc Superconductors and Related Compounds, edited by K. Kuzmany, M. Mehring, and J. Fink, Springer Series in Solid State Science (Springer, Berlin, 1990), Vol. 99.
    • (1995) Recent Progress in Many-Body Theories , vol.4
    • Dagotto, E.1
  • 4
    • 0003394231 scopus 로고
    • Addison-Wesley, New York
    • See for instance, E. Dagotto, in Recent Progress in Many-Body Theories, edited by E. Schachinger, H. Mitter, and H. Sormann (Plenum, New York, 1995), Vol. 4; in High Temperature Superconductivity, edited by K. Bedell, D. Coffey, D. Meltzer, D. Pines, and J. R. Shrieffer (Addison-Wesley, New York, 1990); in Superconductivity, edited by J. G. Bednorz and K. A. Müller, Springer Series in Solid Stale Science (Springer, Berlin, 1990), Vol. 90; in Electronic Properties of High-Tc Superconductors and Related Compounds, edited by K. Kuzmany, M. Mehring, and J. Fink, Springer Series in Solid State Science (Springer, Berlin, 1990), Vol. 99.
    • (1990) High Temperature Superconductivity
    • Bedell, K.1    Coffey, D.2    Meltzer, D.3    Pines, D.4    Shrieffer, J.R.5
  • 5
    • 0003997409 scopus 로고
    • Superconductivity
    • Springer, Berlin
    • See for instance, E. Dagotto, in Recent Progress in Many-Body Theories, edited by E. Schachinger, H. Mitter, and H. Sormann (Plenum, New York, 1995), Vol. 4; in High Temperature Superconductivity, edited by K. Bedell, D. Coffey, D. Meltzer, D. Pines, and J. R. Shrieffer (Addison-Wesley, New York, 1990); in Superconductivity, edited by J. G. Bednorz and K. A. Müller, Springer Series in Solid Stale Science (Springer, Berlin, 1990), Vol. 90; in Electronic Properties of High-Tc Superconductors and Related Compounds, edited by K. Kuzmany, M. Mehring, and J. Fink, Springer Series in Solid State Science (Springer, Berlin, 1990), Vol. 99.
    • (1990) Springer Series in Solid Stale Science , vol.90
    • Bednorz, J.G.1    Müller, K.A.2
  • 6
    • 0347088467 scopus 로고
    • Electronic Properties of High-Tc Superconductors and Related Compounds
    • Springer, Berlin
    • See for instance, E. Dagotto, in Recent Progress in Many-Body Theories, edited by E. Schachinger, H. Mitter, and H. Sormann (Plenum, New York, 1995), Vol. 4; in High Temperature Superconductivity, edited by K. Bedell, D. Coffey, D. Meltzer, D. Pines, and J. R. Shrieffer (Addison-Wesley, New York, 1990); in Superconductivity, edited by J. G. Bednorz and K. A. Müller, Springer Series in Solid Stale Science (Springer, Berlin, 1990), Vol. 90; in Electronic Properties of High-Tc Superconductors and Related Compounds, edited by K. Kuzmany, M. Mehring, and J. Fink, Springer Series in Solid State Science (Springer, Berlin, 1990), Vol. 99.
    • (1990) Springer Series in Solid State Science , vol.99
    • Kuzmany, K.1    Mehring, M.2    Fink, J.3
  • 7
    • 0001268782 scopus 로고
    • L. F. Mattheiss, Phys. Rev. Lett. 58, 1028 (1987); L. F. Mattheiss and D. R. Hamann, Solid State Commun. 63, 395 (1988); J. Yu, A. J. Freeman, and J. H. Xu, Phys. Rev. Lett. 58, 1035 (1987); F. Herman, R. V. Kasowski, and W. Y. Hus, Phys. Rev. B 36, 6904 (1987); 38, 204 (1988); W. E. Pickett, Rev. Mod. Phys. 61, 433 (1989).
    • (1987) Phys. Rev. Lett. , vol.58 , pp. 1028
    • Mattheiss, L.F.1
  • 8
    • 0023397909 scopus 로고
    • L. F. Mattheiss, Phys. Rev. Lett. 58, 1028 (1987); L. F. Mattheiss and D. R. Hamann, Solid State Commun. 63, 395 (1988); J. Yu, A. J. Freeman, and J. H. Xu, Phys. Rev. Lett. 58, 1035 (1987); F. Herman, R. V. Kasowski, and W. Y. Hus, Phys. Rev. B 36, 6904 (1987); 38, 204 (1988); W. E. Pickett, Rev. Mod. Phys. 61, 433 (1989).
    • (1988) Solid State Commun. , vol.63 , pp. 395
    • Mattheiss, L.F.1    Hamann, D.R.2
  • 9
    • 0000269764 scopus 로고
    • L. F. Mattheiss, Phys. Rev. Lett. 58, 1028 (1987); L. F. Mattheiss and D. R. Hamann, Solid State Commun. 63, 395 (1988); J. Yu, A. J. Freeman, and J. H. Xu, Phys. Rev. Lett. 58, 1035 (1987); F. Herman, R. V. Kasowski, and W. Y. Hus, Phys. Rev. B 36, 6904 (1987); 38, 204 (1988); W. E. Pickett, Rev. Mod. Phys. 61, 433 (1989).
    • (1987) Phys. Rev. Lett. , vol.58 , pp. 1035
    • Yu, J.1    Freeman, A.J.2    Xu, J.H.3
  • 10
    • 0001264602 scopus 로고
    • L. F. Mattheiss, Phys. Rev. Lett. 58, 1028 (1987); L. F. Mattheiss and D. R. Hamann, Solid State Commun. 63, 395 (1988); J. Yu, A. J. Freeman, and J. H. Xu, Phys. Rev. Lett. 58, 1035 (1987); F. Herman, R. V. Kasowski, and W. Y. Hus, Phys. Rev. B 36, 6904 (1987); 38, 204 (1988); W. E. Pickett, Rev. Mod. Phys. 61, 433 (1989).
    • (1987) Phys. Rev. B , vol.36 , pp. 6904
    • Herman, F.1    Kasowski, R.V.2    Hus, W.Y.3
  • 11
    • 24544451952 scopus 로고
    • L. F. Mattheiss, Phys. Rev. Lett. 58, 1028 (1987); L. F. Mattheiss and D. R. Hamann, Solid State Commun. 63, 395 (1988); J. Yu, A. J. Freeman, and J. H. Xu, Phys. Rev. Lett. 58, 1035 (1987); F. Herman, R. V. Kasowski, and W. Y. Hus, Phys. Rev. B 36, 6904 (1987); 38, 204 (1988); W. E. Pickett, Rev. Mod. Phys. 61, 433 (1989).
    • (1988) Phys. Rev. B , vol.38 , pp. 204
  • 12
    • 33746998342 scopus 로고
    • L. F. Mattheiss, Phys. Rev. Lett. 58, 1028 (1987); L. F. Mattheiss and D. R. Hamann, Solid State Commun. 63, 395 (1988); J. Yu, A. J. Freeman, and J. H. Xu, Phys. Rev. Lett. 58, 1035 (1987); F. Herman, R. V. Kasowski, and W. Y. Hus, Phys. Rev. B 36, 6904 (1987); 38, 204 (1988); W. E. Pickett, Rev. Mod. Phys. 61, 433 (1989).
    • (1989) Rev. Mod. Phys. , vol.61 , pp. 433
    • Pickett, W.E.1
  • 14
    • 0011689129 scopus 로고
    • T. M. Rice, F. Mila, and T. C. Zhang, Philos. Trans. R. Soc. London, Ser. A 334, 459 (1991); A. Fujimori, E. Takayama-Muromachi, Y. Uchida, and B. Okai, Phys. Rev. B 35, 8814 (1987); J. M. Tranquada, S. M. Heald, A. R. Moodenbaug, and M. Suenaga, ibid. 35, 7187 (1987); J. M. Tranquada, S. M. Heald, A. R. Moodenbaug, G. Liang, and M. Croft, Nature (London) 337, 720 (1989); N. Nücker, J. Fink, B. Renker, D. Ewert, C. Politis, P. J. W. Weijs, and J. C. Fuggle, Z. Phys. B: Condens. Matter 67, 9 (1987); D. Van der Marel, J. Van Elp, G. A. Sawatzky, and D. Heilmann, Phys. Rev. B 37, 5136 (1987); N. Nücker, J. Fink, J. C. Fuggle, P. J. Durham, and W. H. Temmerman, ibid. 37, 5158 (1988).
    • (1991) Philos. Trans. R. Soc. London, Ser. A , vol.334 , pp. 459
    • Rice, T.M.1    Mila, F.2    Zhang, T.C.3
  • 15
    • 0000651890 scopus 로고
    • T. M. Rice, F. Mila, and T. C. Zhang, Philos. Trans. R. Soc. London, Ser. A 334, 459 (1991); A. Fujimori, E. Takayama-Muromachi, Y. Uchida, and B. Okai, Phys. Rev. B 35, 8814 (1987); J. M. Tranquada, S. M. Heald, A. R. Moodenbaug, and M. Suenaga, ibid. 35, 7187 (1987); J. M. Tranquada, S. M. Heald, A. R. Moodenbaug, G. Liang, and M. Croft, Nature (London) 337, 720 (1989); N. Nücker, J. Fink, B. Renker, D. Ewert, C. Politis, P. J. W. Weijs, and J. C. Fuggle, Z. Phys. B: Condens. Matter 67, 9 (1987); D. Van der Marel, J. Van Elp, G. A. Sawatzky, and D. Heilmann, Phys. Rev. B 37, 5136 (1987); N. Nücker, J. Fink, J. C. Fuggle, P. J. Durham, and W. H. Temmerman, ibid. 37, 5158 (1988).
    • (1987) Phys. Rev. B , vol.35 , pp. 8814
    • Fujimori, A.1    Takayama-Muromachi, E.2    Uchida, Y.3    Okai, B.4
  • 16
    • 0001678610 scopus 로고
    • T. M. Rice, F. Mila, and T. C. Zhang, Philos. Trans. R. Soc. London, Ser. A 334, 459 (1991); A. Fujimori, E. Takayama-Muromachi, Y. Uchida, and B. Okai, Phys. Rev. B 35, 8814 (1987); J. M. Tranquada, S. M. Heald, A. R. Moodenbaug, and M. Suenaga, ibid. 35, 7187 (1987); J. M. Tranquada, S. M. Heald, A. R. Moodenbaug, G. Liang, and M. Croft, Nature (London) 337, 720 (1989); N. Nücker, J. Fink, B. Renker, D. Ewert, C. Politis, P. J. W. Weijs, and J. C. Fuggle, Z. Phys. B: Condens. Matter 67, 9 (1987); D. Van der Marel, J. Van Elp, G. A. Sawatzky, and D. Heilmann, Phys. Rev. B 37, 5136 (1987); N. Nücker, J. Fink, J. C. Fuggle, P. J. Durham, and W. H. Temmerman, ibid. 37, 5158 (1988).
    • (1987) Phys. Rev. B , vol.35 , pp. 7187
    • Tranquada, J.M.1    Heald, S.M.2    Moodenbaug, A.R.3    Suenaga, M.4
  • 17
    • 0000611984 scopus 로고
    • T. M. Rice, F. Mila, and T. C. Zhang, Philos. Trans. R. Soc. London, Ser. A 334, 459 (1991); A. Fujimori, E. Takayama-Muromachi, Y. Uchida, and B. Okai, Phys. Rev. B 35, 8814 (1987); J. M. Tranquada, S. M. Heald, A. R. Moodenbaug, and M. Suenaga, ibid. 35, 7187 (1987); J. M. Tranquada, S. M. Heald, A. R. Moodenbaug, G. Liang, and M. Croft, Nature (London) 337, 720 (1989); N. Nücker, J. Fink, B. Renker, D. Ewert, C. Politis, P. J. W. Weijs, and J. C. Fuggle, Z. Phys. B: Condens. Matter 67, 9 (1987); D. Van der Marel, J. Van Elp, G. A. Sawatzky, and D. Heilmann, Phys. Rev. B 37, 5136 (1987); N. Nücker, J. Fink, J. C. Fuggle, P. J. Durham, and W. H. Temmerman, ibid. 37, 5158 (1988).
    • (1989) Nature (London) , vol.337 , pp. 720
    • Tranquada, J.M.1    Heald, S.M.2    Moodenbaug, A.R.3    Liang, G.4    Croft, M.5
  • 18
    • 0002703904 scopus 로고
    • T. M. Rice, F. Mila, and T. C. Zhang, Philos. Trans. R. Soc. London, Ser. A 334, 459 (1991); A. Fujimori, E. Takayama-Muromachi, Y. Uchida, and B. Okai, Phys. Rev. B 35, 8814 (1987); J. M. Tranquada, S. M. Heald, A. R. Moodenbaug, and M. Suenaga, ibid. 35, 7187 (1987); J. M. Tranquada, S. M. Heald, A. R. Moodenbaug, G. Liang, and M. Croft, Nature (London) 337, 720 (1989); N. Nücker, J. Fink, B. Renker, D. Ewert, C. Politis, P. J. W. Weijs, and J. C. Fuggle, Z. Phys. B: Condens. Matter 67, 9 (1987); D. Van der Marel, J. Van Elp, G. A. Sawatzky, and D. Heilmann, Phys. Rev. B 37, 5136 (1987); N. Nücker, J. Fink, J. C. Fuggle, P. J. Durham, and W. H. Temmerman, ibid. 37, 5158 (1988).
    • (1987) Z. Phys. B: Condens. Matter , vol.67 , pp. 9
    • Nücker, N.1    Fink, J.2    Renker, B.3    Ewert, D.4    Politis, C.5    Weijs, P.J.W.6    Fuggle, J.C.7
  • 19
    • 0040688025 scopus 로고
    • T. M. Rice, F. Mila, and T. C. Zhang, Philos. Trans. R. Soc. London, Ser. A 334, 459 (1991); A. Fujimori, E. Takayama-Muromachi, Y. Uchida, and B. Okai, Phys. Rev. B 35, 8814 (1987); J. M. Tranquada, S. M. Heald, A. R. Moodenbaug, and M. Suenaga, ibid. 35, 7187 (1987); J. M. Tranquada, S. M. Heald, A. R. Moodenbaug, G. Liang, and M. Croft, Nature (London) 337, 720 (1989); N. Nücker, J. Fink, B. Renker, D. Ewert, C. Politis, P. J. W. Weijs, and J. C. Fuggle, Z. Phys. B: Condens. Matter 67, 9 (1987); D. Van der Marel, J. Van Elp, G. A. Sawatzky, and D. Heilmann, Phys. Rev. B 37, 5136 (1987); N. Nücker, J. Fink, J. C. Fuggle, P. J. Durham, and W. H. Temmerman, ibid. 37, 5158 (1988).
    • (1987) Phys. Rev. B , vol.37 , pp. 5136
    • Van der Marel, D.1    Van Elp, J.2    Sawatzky, G.A.3    Heilmann, D.4
  • 20
    • 0001080502 scopus 로고
    • T. M. Rice, F. Mila, and T. C. Zhang, Philos. Trans. R. Soc. London, Ser. A 334, 459 (1991); A. Fujimori, E. Takayama-Muromachi, Y. Uchida, and B. Okai, Phys. Rev. B 35, 8814 (1987); J. M. Tranquada, S. M. Heald, A. R. Moodenbaug, and M. Suenaga, ibid. 35, 7187 (1987); J. M. Tranquada, S. M. Heald, A. R. Moodenbaug, G. Liang, and M. Croft, Nature (London) 337, 720 (1989); N. Nücker, J. Fink, B. Renker, D. Ewert, C. Politis, P. J. W. Weijs, and J. C. Fuggle, Z. Phys. B: Condens. Matter 67, 9 (1987); D. Van der Marel, J. Van Elp, G. A. Sawatzky, and D. Heilmann, Phys. Rev. B 37, 5136 (1987); N. Nücker, J. Fink, J. C. Fuggle, P. J. Durham, and W. H. Temmerman, ibid. 37, 5158 (1988).
    • (1988) Phys. Rev. B , vol.37 , pp. 5158
    • Nücker, N.1    Fink, J.2    Fuggle, J.C.3    Durham, P.J.4    Temmerman, W.H.5
  • 22
    • 0020114371 scopus 로고
    • G. Van der Laan, Solid Stale Commun. 42, 165 (1982); A. Fujimori, Phys. Rev. B 39, 793 (1989); K. Okada and A. Kotani, J. Electron, Spectrosc. Relat. Phenom. 52, 313 (1990); H. Eskes, L. H. Tjeng, and G. A. Sawatzky, Phys. Rev. B 41, 288 (1990); O. Gunnarsson et al., ibid. 41, 4811 (1990); C. T. Chen et al., Phys. Rev. Lett. 66, 104 (1991).
    • (1982) Solid Stale Commun. , vol.42 , pp. 165
    • Van der Laan, G.1
  • 23
    • 0002546901 scopus 로고
    • G. Van der Laan, Solid Stale Commun. 42, 165 (1982); A. Fujimori, Phys. Rev. B 39, 793 (1989); K. Okada and A. Kotani, J. Electron, Spectrosc. Relat. Phenom. 52, 313 (1990); H. Eskes, L. H. Tjeng, and G. A. Sawatzky, Phys. Rev. B 41, 288 (1990); O. Gunnarsson et al., ibid. 41, 4811 (1990); C. T. Chen et al., Phys. Rev. Lett. 66, 104 (1991).
    • (1989) Phys. Rev. B , vol.39 , pp. 793
    • Fujimori, A.1
  • 24
    • 0001747890 scopus 로고
    • G. Van der Laan, Solid Stale Commun. 42, 165 (1982); A. Fujimori, Phys. Rev. B 39, 793 (1989); K. Okada and A. Kotani, J. Electron, Spectrosc. Relat. Phenom. 52, 313 (1990); H. Eskes, L. H. Tjeng, and G. A. Sawatzky, Phys. Rev. B 41, 288 (1990); O. Gunnarsson et al., ibid. 41, 4811 (1990); C. T. Chen et al., Phys. Rev. Lett. 66, 104 (1991).
    • (1990) J. Electron, Spectrosc. Relat. Phenom. , vol.52 , pp. 313
    • Okada, K.1    Kotani, A.2
  • 25
    • 0000144797 scopus 로고
    • G. Van der Laan, Solid Stale Commun. 42, 165 (1982); A. Fujimori, Phys. Rev. B 39, 793 (1989); K. Okada and A. Kotani, J. Electron, Spectrosc. Relat. Phenom. 52, 313 (1990); H. Eskes, L. H. Tjeng, and G. A. Sawatzky, Phys. Rev. B 41, 288 (1990); O. Gunnarsson et al., ibid. 41, 4811 (1990); C. T. Chen et al., Phys. Rev. Lett. 66, 104 (1991).
    • (1990) Phys. Rev. B , vol.41 , pp. 288
    • Eskes, H.1    Tjeng, L.H.2    Sawatzky, G.A.3
  • 26
    • 0042642740 scopus 로고
    • G. Van der Laan, Solid Stale Commun. 42, 165 (1982); A. Fujimori, Phys. Rev. B 39, 793 (1989); K. Okada and A. Kotani, J. Electron, Spectrosc. Relat. Phenom. 52, 313 (1990); H. Eskes, L. H. Tjeng, and G. A. Sawatzky, Phys. Rev. B 41, 288 (1990); O. Gunnarsson et al., ibid. 41, 4811 (1990); C. T. Chen et al., Phys. Rev. Lett. 66, 104 (1991).
    • (1990) Phys. Rev. B , vol.41 , pp. 4811
    • Gunnarsson, O.1
  • 27
    • 0001318914 scopus 로고
    • G. Van der Laan, Solid Stale Commun. 42, 165 (1982); A. Fujimori, Phys. Rev. B 39, 793 (1989); K. Okada and A. Kotani, J. Electron, Spectrosc. Relat. Phenom. 52, 313 (1990); H. Eskes, L. H. Tjeng, and G. A. Sawatzky, Phys. Rev. B 41, 288 (1990); O. Gunnarsson et al., ibid. 41, 4811 (1990); C. T. Chen et al., Phys. Rev. Lett. 66, 104 (1991).
    • (1991) Phys. Rev. Lett. , vol.66 , pp. 104
    • Chen, C.T.1
  • 29
    • 33744614921 scopus 로고
    • F. C. Zhang and T. M. Rice, Phys. Rev. B 37, 3759 (1988); 41, 7243 (1990).
    • (1990) Phys. Rev. B , vol.41 , pp. 7243
  • 31
    • 26544476598 scopus 로고
    • H. Eskes and G. A. Sawatzky, Phys. Rev. Lett. 61, 1415 (1988); H. Eskes, G. A. Sawatzky, and L. F. Feiner, Physica C 160, 424 (1989); J. H. Jefferson, H. Eskes, and L. F. Feiner, Phys. Rev. B 45, 7959 (1992).
    • (1988) Phys. Rev. Lett. , vol.61 , pp. 1415
    • Eskes, H.1    Sawatzky, G.A.2
  • 32
    • 0024750049 scopus 로고
    • H. Eskes and G. A. Sawatzky, Phys. Rev. Lett. 61, 1415 (1988); H. Eskes, G. A. Sawatzky, and L. F. Feiner, Physica C 160, 424 (1989); J. H. Jefferson, H. Eskes, and L. F. Feiner, Phys. Rev. B 45, 7959 (1992).
    • (1989) Physica C , vol.160 , pp. 424
    • Eskes, H.1    Sawatzky, G.A.2    Feiner, L.F.3
  • 33
    • 0001352079 scopus 로고
    • H. Eskes and G. A. Sawatzky, Phys. Rev. Lett. 61, 1415 (1988); H. Eskes, G. A. Sawatzky, and L. F. Feiner, Physica C 160, 424 (1989); J. H. Jefferson, H. Eskes, and L. F. Feiner, Phys. Rev. B 45, 7959 (1992).
    • (1992) Phys. Rev. B , vol.45 , pp. 7959
    • Jefferson, J.H.1    Eskes, H.2    Feiner, L.F.3
  • 45
    • 0003470014 scopus 로고
    • Saunders College Publishing, New York
    • P. A. Cox, Transition Metal Oxides. An Introduction to Their Electronic Structure and Properties (Clarendon, Oxford, 1995); N. Ashcroft and N. D. Mermin, Solid State Physics (Saunders College Publishing, New York, 1976).
    • (1976) Solid State Physics
    • Ashcroft, N.1    Mermin, N.D.2
  • 48
    • 0003631340 scopus 로고
    • edited by G. Pacchioni and P. Bagus (Plenum, New York)
    • R. L. Martin, in Cluster Models for Surface and Bulk Phenomena, edited by G. Pacchioni and P. Bagus (Plenum, New York, 1992); R. L. Martin and P. J. Hay, J. Chem. Phys. 98, 8680 (1993); R. L. Martin, ibid. 98, 8691 (1993); Phys. Rev. B 53, 15501 (1996); 54, R9647 (1996); Physica B 163, 583 (1990).
    • (1992) Cluster Models for Surface and Bulk Phenomena
    • Martin, R.L.1
  • 49
    • 0000812149 scopus 로고
    • R. L. Martin, in Cluster Models for Surface and Bulk Phenomena, edited by G. Pacchioni and P. Bagus (Plenum, New York, 1992); R. L. Martin and P. J. Hay, J. Chem. Phys. 98, 8680 (1993); R. L. Martin, ibid. 98, 8691 (1993); Phys. Rev. B 53, 15501 (1996); 54, R9647 (1996); Physica B 163, 583 (1990).
    • (1993) J. Chem. Phys. , vol.98 , pp. 8680
    • Martin, R.L.1    Hay, P.J.2
  • 50
    • 0001055184 scopus 로고
    • R. L. Martin, in Cluster Models for Surface and Bulk Phenomena, edited by G. Pacchioni and P. Bagus (Plenum, New York, 1992); R. L. Martin and P. J. Hay, J. Chem. Phys. 98, 8680 (1993); R. L. Martin, ibid. 98, 8691 (1993); Phys. Rev. B 53, 15501 (1996); 54, R9647 (1996); Physica B 163, 583 (1990).
    • (1993) J. Chem. Phys. , vol.98 , pp. 8691
    • Martin, R.L.1
  • 51
    • 0000800860 scopus 로고    scopus 로고
    • R. L. Martin, in Cluster Models for Surface and Bulk Phenomena, edited by G. Pacchioni and P. Bagus (Plenum, New York, 1992); R. L. Martin and P. J. Hay, J. Chem. Phys. 98, 8680 (1993); R. L. Martin, ibid. 98, 8691 (1993); Phys. Rev. B 53, 15501 (1996); 54, R9647 (1996); Physica B 163, 583 (1990).
    • (1996) Phys. Rev. B , vol.53 , pp. 15501
  • 52
    • 0003990029 scopus 로고    scopus 로고
    • R. L. Martin, in Cluster Models for Surface and Bulk Phenomena, edited by G. Pacchioni and P. Bagus (Plenum, New York, 1992); R. L. Martin and P. J. Hay, J. Chem. Phys. 98, 8680 (1993); R. L. Martin, ibid. 98, 8691 (1993); Phys. Rev. B 53, 15501 (1996); 54, R9647 (1996); Physica B 163, 583 (1990).
    • (1996) Phys. Rev. B , vol.54
  • 53
    • 24544435827 scopus 로고
    • R. L. Martin, in Cluster Models for Surface and Bulk Phenomena, edited by G. Pacchioni and P. Bagus (Plenum, New York, 1992); R. L. Martin and P. J. Hay, J. Chem. Phys. 98, 8680 (1993); R. L. Martin, ibid. 98, 8691 (1993); Phys. Rev. B 53, 15501 (1996); 54, R9647 (1996); Physica B 163, 583 (1990).
    • (1990) Physica B , vol.163 , pp. 583
  • 55
    • 33745770836 scopus 로고
    • P. J. Hay and W. R. Wadt, J. Chem. Phys. 82, 270 (1985); W. R. Wadt and P. J. Hay, ibid. 82, 284 (1985); P. J. Hay and W. R. Wadt, ibid. 82, 299 (1985).
    • (1985) J. Chem. Phys. , vol.82 , pp. 270
    • Hay, P.J.1    Wadt, W.R.2
  • 56
    • 0006073669 scopus 로고
    • P. J. Hay and W. R. Wadt, J. Chem. Phys. 82, 270 (1985); W. R. Wadt and P. J. Hay, ibid. 82, 284 (1985); P. J. Hay and W. R. Wadt, ibid. 82, 299 (1985).
    • (1985) J. Chem. Phys. , vol.82 , pp. 284
    • Wadt, W.R.1    Hay, P.J.2
  • 57
    • 27344448074 scopus 로고
    • P. J. Hay and W. R. Wadt, J. Chem. Phys. 82, 270 (1985); W. R. Wadt and P. J. Hay, ibid. 82, 284 (1985); P. J. Hay and W. R. Wadt, ibid. 82, 299 (1985).
    • (1985) J. Chem. Phys. , vol.82 , pp. 299
    • Hay, P.J.1    Wadt, W.R.2
  • 59
    • 0003568278 scopus 로고
    • edited by H. F. Schaefer (Plenum, New York)
    • T. H. Dunning, in Modern Theoretical Chemistry, edited by H. F. Schaefer (Plenum, New York, 1977); S. Huzinaga, J. Chem. Phys. 42, 1293 (1965).
    • (1977) Modern Theoretical Chemistry
    • Dunning, T.H.1
  • 60
    • 36849140788 scopus 로고
    • T. H. Dunning, in Modern Theoretical Chemistry, edited by H. F. Schaefer (Plenum, New York, 1977); S. Huzinaga, J. Chem. Phys. 42, 1293 (1965).
    • (1965) J. Chem. Phys. , vol.42 , pp. 1293
    • Huzinaga, S.1
  • 61
    • 33646667685 scopus 로고
    • Ph. Durand and J. C. Barthelat, Theor. Chim. Acta 38, 283 (1975); J. C. Barthelat, Ph. Durand, and A. Serafmi, Mol. Phys. 33, 159 (1977).
    • (1975) Theor. Chim. Acta , vol.38 , pp. 283
    • Durand, Ph.1    Barthelat, J.C.2
  • 64
    • 0000451421 scopus 로고
    • J. R. Tessman, A. H. Kahn, and W. Shockley, Phys. Rev. 92, 890 (1953); R. Kirch, A, Gérard, and M. Wautelet, J. Phys. C 7, 3633 (1974).
    • (1974) J. Phys. C , vol.7 , pp. 3633
    • Kirch, R.1    Gérard, A.2    Wautelet, M.3
  • 65
    • 0347462915 scopus 로고
    • W. Heisenberg, Z. Phys. 49, 619 (1928); P. A. M. Dirac, Proc. R. Soc. London, Ser. A 123, 714 (1929); P. A. M. Dirac, The Principles of Quantum Mechanics (Clarendon, Oxford, 1947); J. H. Van Vleck, The Theory of Electric and Magnetic Susceptibilities (Oxford University Press, Oxford, 1932).
    • (1928) Z. Phys. , vol.49 , pp. 619
    • Heisenberg, W.1
  • 66
    • 0347462915 scopus 로고
    • W. Heisenberg, Z. Phys. 49, 619 (1928); P. A. M. Dirac, Proc. R. Soc. London, Ser. A 123, 714 (1929); P. A. M. Dirac, The Principles of Quantum Mechanics (Clarendon, Oxford, 1947); J. H. Van Vleck, The Theory of Electric and Magnetic Susceptibilities (Oxford University Press, Oxford, 1932).
    • (1929) Proc. R. Soc. London, Ser. A , vol.123 , pp. 714
    • Dirac, P.A.M.1
  • 67
    • 0347462915 scopus 로고
    • Clarendon, Oxford
    • W. Heisenberg, Z. Phys. 49, 619 (1928); P. A. M. Dirac, Proc. R. Soc. London, Ser. A 123, 714 (1929); P. A. M. Dirac, The Principles of Quantum Mechanics (Clarendon, Oxford, 1947); J. H. Van Vleck, The Theory of Electric and Magnetic Susceptibilities (Oxford University Press, Oxford, 1932).
    • (1947) The Principles of Quantum Mechanics
    • Dirac, P.A.M.1
  • 68
    • 0347462915 scopus 로고
    • Oxford University Press, Oxford
    • W. Heisenberg, Z. Phys. 49, 619 (1928); P. A. M. Dirac, Proc. R. Soc. London, Ser. A 123, 714 (1929); P. A. M. Dirac, The Principles of Quantum Mechanics (Clarendon, Oxford, 1947); J. H. Van Vleck, The Theory of Electric and Magnetic Susceptibilities (Oxford University Press, Oxford, 1932).
    • (1932) The Theory of Electric and Magnetic Susceptibilities
    • Van Vleck, J.H.1
  • 69
    • 2242480488 scopus 로고
    • J. Miralles, O. Castell, and R. Caballol, Chem. Phys. 17, 377 (1994); J. Miralles, J. P. Daudey, and R. Caballol, Chem. Phys. Lett. 198, 555 (1992); O. Castell, R. Caballol, R. Subra, and A. Grand, J. Phys. Chem. 99, 154 (1995); K. Handrick, J. P. Malrieu, and O. Castell, J. Chem. Phys. 3, 101 (1994); O. Castell, R. Caballol, V. M. Garcia, and K. Handrick, Inorg. Chem. 35, 1609 (1996).
    • (1994) Chem. Phys. , vol.17 , pp. 377
    • Miralles, J.1    Castell, O.2    Caballol, R.3
  • 70
    • 0001161577 scopus 로고
    • J. Miralles, O. Castell, and R. Caballol, Chem. Phys. 17, 377 (1994); J. Miralles, J. P. Daudey, and R. Caballol, Chem. Phys. Lett. 198, 555 (1992); O. Castell, R. Caballol, R. Subra, and A. Grand, J. Phys. Chem. 99, 154 (1995); K. Handrick, J. P. Malrieu, and O. Castell, J. Chem. Phys. 3, 101 (1994); O. Castell, R. Caballol, V. M. Garcia, and K. Handrick, Inorg. Chem. 35, 1609 (1996).
    • (1992) Chem. Phys. Lett. , vol.198 , pp. 555
    • Miralles, J.1    Daudey, J.P.2    Caballol, R.3
  • 71
    • 0001162949 scopus 로고
    • J. Miralles, O. Castell, and R. Caballol, Chem. Phys. 17, 377 (1994); J. Miralles, J. P. Daudey, and R. Caballol, Chem. Phys. Lett. 198, 555 (1992); O. Castell, R. Caballol, R. Subra, and A. Grand, J. Phys. Chem. 99, 154 (1995); K. Handrick, J. P. Malrieu, and O. Castell, J. Chem. Phys. 3, 101 (1994); O. Castell, R. Caballol, V. M. Garcia, and K. Handrick, Inorg. Chem. 35, 1609 (1996).
    • (1995) J. Phys. Chem. , vol.99 , pp. 154
    • Castell, O.1    Caballol, R.2    Subra, R.3    Grand, A.4
  • 72
    • 0011495133 scopus 로고
    • J. Miralles, O. Castell, and R. Caballol, Chem. Phys. 17, 377 (1994); J. Miralles, J. P. Daudey, and R. Caballol, Chem. Phys. Lett. 198, 555 (1992); O. Castell, R. Caballol, R. Subra, and A. Grand, J. Phys. Chem. 99, 154 (1995); K. Handrick, J. P. Malrieu, and O. Castell, J. Chem. Phys. 3, 101 (1994); O. Castell, R. Caballol, V. M. Garcia, and K. Handrick, Inorg. Chem. 35, 1609 (1996).
    • (1994) J. Chem. Phys. , vol.3 , pp. 101
    • Handrick, K.1    Malrieu, J.P.2    Castell, O.3
  • 73
    • 0001408060 scopus 로고    scopus 로고
    • J. Miralles, O. Castell, and R. Caballol, Chem. Phys. 17, 377 (1994); J. Miralles, J. P. Daudey, and R. Caballol, Chem. Phys. Lett. 198, 555 (1992); O. Castell, R. Caballol, R. Subra, and A. Grand, J. Phys. Chem. 99, 154 (1995); K. Handrick, J. P. Malrieu, and O. Castell, J. Chem. Phys. 3, 101 (1994); O. Castell, R. Caballol, V. M. Garcia, and K. Handrick, Inorg. Chem. 35, 1609 (1996).
    • (1996) Inorg. Chem. , vol.35 , pp. 1609
    • Castell, O.1    Caballol, R.2    Garcia, V.M.3    Handrick, K.4
  • 77
    • 0030593381 scopus 로고    scopus 로고
    • A. B. Van Oosten, R. Broer, and W. C. Nieuwpoort, Int. J. Quantum Chem., Quantum Chem. Symp. 29, 241 (1995); Chem. Phys. Lett. 257, 207 (1996).
    • (1996) Chem. Phys. Lett. , vol.257 , pp. 207


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