메뉴 건너뛰기




Volumn 71, Issue 24, 2005, Pages

Structure-dependent ferroelectricity of niobium clusters (NbN,N=2-52)

Author keywords

[No Author keywords available]

Indexed keywords


EID: 28244442435     PISSN: 10980121     EISSN: 1550235X     Source Type: Journal    
DOI: 10.1103/PhysRevB.71.245415     Document Type: Article
Times cited : (22)

References (22)
  • 1
    • 0038813676 scopus 로고    scopus 로고
    • SCIEAS 0036-8075 10.1126/science.1083247
    • R. Moro, X. Xu, S. Yin, and W. A. de Heer, Science SCIEAS 0036-8075 10.1126/science.1083247 300, 1265 (2003).
    • (2003) Science , vol.300 , pp. 1265
    • Moro, R.1    Xu, X.2    Yin, S.3    De Heer, W.A.4
  • 2
    • 0037541097 scopus 로고    scopus 로고
    • JCPSA6 0021-9606 10.1063/1.1559486
    • M. B. Knickelbein, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1559486 118, 6230 (2003).
    • (2003) J. Chem. Phys. , vol.118 , pp. 6230
    • Knickelbein, M.B.1
  • 4
    • 0001066048 scopus 로고
    • PLRAAN 1050-2947 10.1103/PhysRevA.47.R774
    • L. Goodwin and D. R. Salahub, Phys. Rev. A PLRAAN 1050-2947 10.1103/PhysRevA.47.R774 47, R774 (1993).
    • (1993) Phys. Rev. a , vol.47 , pp. 774
    • Goodwin, L.1    Salahub, D.R.2
  • 5
    • 0038546249 scopus 로고    scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.54.1549
    • H. Gronbeck and A. Rosen, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.54.1549 54, 1549 (1996);
    • (1996) Phys. Rev. B , vol.54 , pp. 1549
    • Gronbeck, H.1    Rosen, A.2
  • 6
    • 0032375355 scopus 로고    scopus 로고
    • PLRAAN 1050-2947 10.1103/PhysRevA.58.4630
    • H. Gronbeck, A. Rosen, and W. Andreoni, Phys. Rev. A PLRAAN 1050-2947 10.1103/PhysRevA.58.4630 58, 4630 (1998).
    • (1998) Phys. Rev. a , vol.58 , pp. 4630
    • Gronbeck, H.1    Rosen, A.2    Andreoni, W.3
  • 7
    • 0037088243 scopus 로고    scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.65.125403
    • V. Kumar and Y. Kawazoe, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.65.125403 65, 125403 (2002).
    • (2002) Phys. Rev. B , vol.65 , pp. 125403
    • Kumar, V.1    Kawazoe, Y.2
  • 10
    • 42749107800 scopus 로고    scopus 로고
    • PLEEE8 1063-651X 10.1103/PhysRevE.67.066704
    • C. I. Chou, R. S. Han, S. P. Li, and T. K. Lee, Phys. Rev. E PLEEE8 1063-651X 10.1103/PhysRevE.67.066704 67, 066704 (2003).
    • (2003) Phys. Rev. e , vol.67 , pp. 066704
    • Chou, C.I.1    Han, R.S.2    Li, S.P.3    Lee, T.K.4
  • 11
    • 0042366190 scopus 로고    scopus 로고
    • SCIEAS 0036-8075 10.1126/science.1086189
    • V. N. Manoharan, M. T. Elsesser, and D. J. Pine, Science SCIEAS 0036-8075 10.1126/science.1086189 301, 483 (2003).
    • (2003) Science , vol.301 , pp. 483
    • Manoharan, V.N.1    Elsesser, M.T.2    Pine, D.J.3
  • 15
    • 34447260582 scopus 로고
    • JCPSA6 0021-9606 10.1063/1.458452
    • DMol3 is a density-functional-theory-based package with atomic basis, distributed by Accelrys [B. Delley, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.458452 92, 508 (1990)].
    • (1990) J. Chem. Phys. , vol.92 , pp. 508
    • Delley, B.1
  • 18
    • 0003754095 scopus 로고
    • edited by P. Ziesche and H. Eschrig (Akademie Verlag, Berlin
    • J. P. Perdew, in Electronic Structure of Solids '91, edited by, P. Ziesche, and, H. Eschrig, (Akademie Verlag, Berlin, 1991);
    • (1991) Electronic Structure of Solids '91
    • Perdew, J.P.1
  • 21
    • 0142057634 scopus 로고
    • CHREAY. 0009-2665
    • The BE and bond length of Nb2, obtained by RECP (AESRC), are 3.38 (4.88) eV and 2.18 (2.15) Ã, respectively. The BE of AESRC agrees well with the experimental value of 4.86±0.02eV [M. D. Morse, Chem. Rev. (Washington, D.C.) CHREAY 0009-2665 86, 1049 (1986)], but that of RECP underestimates it. However, as we shall show, the structural and energetic features for NbN obtained by the two methods are in satisfactory agreement.
    • (1986) Chem. Rev. (Washington, D.C.) , vol.86 , pp. 1049
    • Morse, M.D.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.