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Volumn 107, Issue 20, 1997, Pages 8554-8560

Density-functional thermochemistry. V. Systematic optimization of exchange-correlation functionals

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EID: 0344718335     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.475007     Document Type: Article
Times cited : (1765)

References (25)
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    • ;A. D. Becke, J. Chem. Phys. 104, 1040 (1996). Note that integral signs were mistakenly omitted from many equations in this reference, thus leading to possible confusion between energies and energy densities.
    • (1996) J. Chem. Phys. , vol.104 , pp. 1040
    • Becke, A.D.1
  • 15
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    • H. Stoll, C. M. E. Pavlidou, and H. Preuss, Theor. Chim. Acta 49, 143 (1978); H. Stoll, E. Golka, and H. Preuss, Theor. Chim. Acta 55, 29 (1980).
    • (1980) Theor. Chim. Acta , vol.55 , pp. 29
    • Stoll, H.1    Golka, E.2    Preuss, H.3
  • 17
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    • A. D. Becke, J. Chem. Phys. 88, 2547 (1988); A. D. Becke and R. M. Dickson, J. Chem. Phys. 89, 2993 (1988); 92, 3610 (1990); A. D. Becke, Int. J. Quantum Chem. Quantum Chem. Symp. 23, 599 (1989).
    • (1988) J. Chem. Phys. , vol.88 , pp. 2547
    • Becke, A.D.1
  • 18
    • 5244370391 scopus 로고
    • A. D. Becke, J. Chem. Phys. 88, 2547 (1988); A. D. Becke and R. M. Dickson, J. Chem. Phys. 89, 2993 (1988); 92, 3610 (1990); A. D. Becke, Int. J. Quantum Chem. Quantum Chem. Symp. 23, 599 (1989).
    • (1988) J. Chem. Phys. , vol.89 , pp. 2993
    • Becke, A.D.1    Dickson, R.M.2
  • 19
    • 36549099234 scopus 로고
    • A. D. Becke, J. Chem. Phys. 88, 2547 (1988); A. D. Becke and R. M. Dickson, J. Chem. Phys. 89, 2993 (1988); 92, 3610 (1990); A. D. Becke, Int. J. Quantum Chem. Quantum Chem. Symp. 23, 599 (1989).
    • (1990) J. Chem. Phys. , vol.92 , pp. 3610
  • 20
    • 84990699580 scopus 로고
    • A. D. Becke, J. Chem. Phys. 88, 2547 (1988); A. D. Becke and R. M. Dickson, J. Chem. Phys. 89, 2993 (1988); 92, 3610 (1990); A. D. Becke, Int. J. Quantum Chem. Quantum Chem. Symp. 23, 599 (1989).
    • (1989) Int. J. Quantum Chem. Quantum Chem. Symp. , vol.23 , pp. 599
    • Becke, A.D.1
  • 23
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    • H. B. Shore, J. H. Rose, and E. Zaremba, Phys. Rev. B 15, 2858 (1977); K. Schwarz, Chem. Phys. Lett. 57, 605 (1978).
    • (1978) Chem. Phys. Lett. , vol.57 , pp. 605
    • Schwarz, K.1
  • 24
    • 85033323112 scopus 로고    scopus 로고
    • Geometries of Ref. 17, provided by P. M. W. Gill
    • Geometries of Ref. 17, provided by P. M. W. Gill.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.