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Volumn 56, Issue 15, 1997, Pages 9282-9285

Plane-wave-basis pseudopotential calculations of the surface relaxations of Ti(0001) and Zr(0001)

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EID: 0038609931     PISSN: 10980121     EISSN: 1550235X     Source Type: Journal    
DOI: 10.1103/PhysRevB.56.9282     Document Type: Article
Times cited : (21)

References (23)
  • 9
    • 0042113153 scopus 로고
    • W. Kohn and L. J. Sham, 140, A1133 (1965).
    • (1965) , vol.140 , pp. A1133
    • Kohn, W.1    Sham, L.2
  • 10
    • 0026838208 scopus 로고
    • Using the embedded atom method, Chen [Surf. Sci. 264, L162 (1992)] found (Formula presented) for Zr(0001).
    • (1992) Surf. Sci. , vol.264 , pp. L162
  • 11
    • 0001275221 scopus 로고
    • Methfessel, Hennig, and Scheffler [Phys. Rev. B 46, 4816 (1992)] investigated the relaxation of the (111) surface of a hypothetical fcc Zr crystal and found (Formula presented) On the other hand, using the LAPW method, Feibelman (Ref. 7) found (Formula presented) for Zr(111).
    • (1992) Phys. Rev. B , vol.46 , pp. 4816
  • 21
    • 4243412584 scopus 로고    scopus 로고
    • J.-H. Cho and M. Scheffler, Phys. Rev. Lett. 78, 1299 (1997); S. Narasimhan and M. Scheffler, Z. Phys. Chem. (to be published).
    • (1997) Phys. Rev. Lett. , vol.78 , pp. 1299
    • Scheffler, M.1
  • 22
    • 85037890192 scopus 로고    scopus 로고
    • K. Pohl, J.-H. Cho, K. Terakura, M. Scheffler, and E. W. Plummer (unpublished): using the same model, they found that thermal vibrations increase the first interlayer spacing of Be(0001)by 1.7% at 300 K.
    • Pohl, K.1    Terakura, K.2    Scheffler, M.3    Plummer, E.4


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.