-
3
-
-
0003610689
-
-
10.1063/1.364018
-
L. Sugiura, J. Appl. Phys. 81, 1633 (1997). 10.1063/1.364018
-
(1997)
J. Appl. Phys.
, vol.81
, pp. 1633
-
-
Sugiura, L.1
-
4
-
-
0001755832
-
-
10.1103/PhysRevB.47.4215
-
A. Garcia and M. L. Cohen, Phys. Rev. B 47, 4215 (1993). 10.1103/PhysRevB.47.4215
-
(1993)
Phys. Rev. B
, vol.47
, pp. 4215
-
-
Garcia, A.1
Cohen, M.L.2
-
5
-
-
0001359310
-
-
10.1103/PhysRevB.45.12130;
-
Chin-Yu Yeh, Z. W. Lu, S. Froyen, and A. Zunger, Phys. Rev. B 45, 12130 (1992) 10.1103/PhysRevB.45.12130
-
(1992)
Phys. Rev. B
, vol.45
, pp. 12130
-
-
Yeh, C.1
Lu, Z.W.2
Froyen, S.3
Zunger, A.4
-
6
-
-
35949006090
-
-
10.1103/PhysRevB.46.10086
-
Chin-Yu Yeh, Z. W. Lu, S. Froyen, and A. Zunger, Phys. Rev. B 46, 10086 (1992). 10.1103/PhysRevB.46.10086
-
(1992)
Phys. Rev. B
, vol.46
, pp. 10086
-
-
Yeh, C.1
Lu, Z.W.2
Froyen, S.3
Zunger, A.4
-
10
-
-
47949101196
-
-
10.1021/nl080319y
-
G. Patriarche, F. Glas, M. Tchernycheva, C. Sartel, L. Largeau, and J.-C. Harmand, Nano Lett. 8, 1638 (2008). 10.1021/nl080319y
-
(2008)
Nano Lett.
, vol.8
, pp. 1638
-
-
Patriarche, G.1
Glas, F.2
Tchernycheva, M.3
Sartel, C.4
Largeau, L.5
Harmand, J.-C.6
-
11
-
-
0026899151
-
-
10.1143/JJAP.31.2061
-
M. Koguchi, H. Kakibayashi, M. Yazawa, K. Hiruma, and T. Katsuyama, Jpn. J. Appl. Phys. 31, 2061 (1992). 10.1143/JJAP.31.2061
-
(1992)
Jpn. J. Appl. Phys.
, vol.31
, pp. 2061
-
-
Koguchi, M.1
Kakibayashi, H.2
Yazawa, M.3
Hiruma, K.4
Katsuyama, T.5
-
12
-
-
33846107436
-
-
10.1088/0957-4484/17/22/006
-
C. X. Shan, Z. Liu, X. T. Zhang, C. C. Wong, and S. K. Hark, Nanotechnology 17, 5561 (2006). 10.1088/0957-4484/17/22/006
-
(2006)
Nanotechnology
, vol.17
, pp. 5561
-
-
Shan, C.X.1
Liu, Z.2
Zhang, X.T.3
Wong, C.C.4
Hark, S.K.5
-
13
-
-
33645986169
-
-
10.1143/JJAP.45.L275
-
T. Akiyama, K. Sano, K. Nakamura, and T. Ito, Jpn. J. Appl. Phys. 45, L275 (2006). 10.1143/JJAP.45.L275
-
(2006)
Jpn. J. Appl. Phys.
, vol.45
, pp. 275
-
-
Akiyama, T.1
Sano, K.2
Nakamura, K.3
Ito, T.4
-
15
-
-
42749099691
-
-
10.1103/PhysRevLett.93.216401
-
G. M. Dalpian and S.-H. Wei, Phys. Rev. Lett. 93, 216401 (2004). 10.1103/PhysRevLett.93.216401
-
(2004)
Phys. Rev. Lett.
, vol.93
, pp. 216401
-
-
Dalpian, G.M.1
Wei, S.-H.2
-
17
-
-
27744530520
-
-
10.1103/PhysRevLett.94.216101
-
V. K. Lazarov, J. Zimmerman, S. H. Cheung, L. Li, M. Weinert, and M. Gajdardziska-Josifovska, Phys. Rev. Lett. 94, 216101 (2005). 10.1103/PhysRevLett.94.216101
-
(2005)
Phys. Rev. Lett.
, vol.94
, pp. 216101
-
-
Lazarov, V.K.1
Zimmerman, J.2
Cheung, S.H.3
Li, L.4
Weinert, M.5
Gajdardziska-Josifovska, M.6
-
20
-
-
0001032965
-
-
10.1103/PhysRevB.50.6642
-
Z. W. Lu, D. B. Laks, S.-H. Wei, and A. Zunger, Phys. Rev. B 50, 6642 (1994). 10.1103/PhysRevB.50.6642
-
(1994)
Phys. Rev. B
, vol.50
, pp. 6642
-
-
Lu, Z.W.1
Laks, D.B.2
Wei, S.-H.3
Zunger, A.4
-
23
-
-
56349167201
-
-
10.1103/PhysRevB.78.193301
-
H. J. Xiang, S.-H. Wei, J. L. F. Da Silva, and J. Li, Phys. Rev. B 78, 193301 (2008). 10.1103/PhysRevB.78.193301
-
(2008)
Phys. Rev. B
, vol.78
, pp. 193301
-
-
Xiang, H.J.1
Wei, S.-H.2
Da Silva, J.L.F.3
Li, J.4
-
24
-
-
29144453140
-
-
10.1103/PhysRev.145.637
-
P. Keating, Phys. Rev. 145, 637 (1966). 10.1103/PhysRev.145.637
-
(1966)
Phys. Rev.
, vol.145
, pp. 637
-
-
Keating, P.1
-
25
-
-
35949027701
-
-
10.1103/PhysRevB.1.4005
-
R. Martin, Phys. Rev. B 1, 4005 (1970). 10.1103/PhysRevB.1.4005
-
(1970)
Phys. Rev. B
, vol.1
, pp. 4005
-
-
Martin, R.1
-
26
-
-
0000557678
-
-
10.1103/PhysRevB.30.6217
-
J. L. Martins and A. Zunger, Phys. Rev. B 30, 6217 (1984). 10.1103/PhysRevB.30.6217
-
(1984)
Phys. Rev. B
, vol.30
, pp. 6217
-
-
Martins, J.L.1
Zunger, A.2
-
28
-
-
70350614395
-
-
Our first-principles DFT calculations were performed on the basis of the projector-augmented wave method (Ref.) encoded in the Vienna ab initio simulation package (Ref.) using the local-density approximation (Ref.). For relaxed structures, the atomic forces are less than 0.01eV/.
-
Our first-principles DFT calculations were performed on the basis of the projector-augmented wave method (Ref.) encoded in the Vienna ab initio simulation package (Ref.) using the local-density approximation (Ref.). For relaxed structures, the atomic forces are less than 0.01eV/.
-
-
-
-
29
-
-
25744460922
-
-
10.1103/PhysRevB.50.17953;
-
P. E. Blöchl, Phys. Rev. B 50, 17953 (1994) 10.1103/PhysRevB.50. 17953
-
(1994)
Phys. Rev. B
, vol.50
, pp. 17953
-
-
Blöchl, P.E.1
-
30
-
-
0011236321
-
-
10.1103/PhysRevB.59.1758
-
G. Kresse and D. Joubert, Phys. Rev. B 59, 1758 (1999). 10.1103/PhysRevB.59.1758
-
(1999)
Phys. Rev. B
, vol.59
, pp. 1758
-
-
Kresse, G.1
Joubert, D.2
-
33
-
-
26144450583
-
-
10.1103/PhysRevB.23.5048
-
J. P. Perdew and A. Zunger, Phys. Rev. B 23, 5048 (1981). 10.1103/PhysRevB.23.5048
-
(1981)
Phys. Rev. B
, vol.23
, pp. 5048
-
-
Perdew, J.P.1
Zunger, A.2
-
35
-
-
70350586825
-
-
For each bond involving the atom i, half of bond-stretching energy is contributed to the atom i. The bond-bending energy contributions from atom i include all bond angles which are centered at atom i.
-
For each bond involving the atom i, half of bond-stretching energy is contributed to the atom i. The bond-bending energy contributions from atom i include all bond angles which are centered at atom i.
-
-
-
-
36
-
-
4243494770
-
-
10.1103/PhysRevLett.56.2391
-
S.-H. Wei and A. Zunger, Phys. Rev. Lett. 56, 2391 (1986). 10.1103/PhysRevLett.56.2391
-
(1986)
Phys. Rev. Lett.
, vol.56
, pp. 2391
-
-
Wei, S.-H.1
Zunger, A.2
-
37
-
-
45749105515
-
-
10.1103/PhysRevB.77.245209
-
Y. Z. Zhu, G. D. Chen, H. Ye, A. Walsh, C. Y. Moon, and S.-H. Wei, Phys. Rev. B 77, 245209 (2008). 10.1103/PhysRevB.77.245209
-
(2008)
Phys. Rev. B
, vol.77
, pp. 245209
-
-
Zhu, Y.Z.1
Chen, G.D.2
Ye, H.3
Walsh, A.4
Moon, C.Y.5
Wei, S.-H.6
|