-
1
-
-
0041429278
-
-
10.1126/science.1086963;
-
M. Ouyang and D. D. Awschalom, Science 301, 1074 (2003) 10.1126/science.1086963
-
(2003)
Science
, vol.301
, pp. 1074
-
-
Ouyang, M.1
Awschalom, D.D.2
-
2
-
-
34547375971
-
-
10.1103/PhysRevLett.98.216601;
-
W. Harneit, C. Boehme, S. Schaefer, K. Huebener, K. Fostiropoulos, and K. Lips, Phys. Rev. Lett. 98, 216601 (2007) 10.1103/PhysRevLett.98.216601
-
(2007)
Phys. Rev. Lett.
, vol.98
, pp. 216601
-
-
Harneit, W.1
Boehme, C.2
Schaefer, S.3
Huebener, K.4
Fostiropoulos, K.5
Lips, K.6
-
3
-
-
34248327686
-
-
10.1038/nnano.2007.64
-
S. Pramanik, C.-G. Stefanita, S. Patibandla, S. Bandyopadhyay, K. Garre, N. Harth, and M. Cahay, Nat. Nanotechnol. 2, 216 (2007). 10.1038/nnano.2007.64
-
(2007)
Nat. Nanotechnol.
, vol.2
, pp. 216
-
-
Pramanik, S.1
Stefanita, C.-G.2
Patibandla, S.3
Bandyopadhyay, S.4
Garre, K.5
Harth, N.6
Cahay, M.7
-
5
-
-
0036531589
-
-
10.1016/S0038-1098(02)00090-X
-
V. Dediu, C. Taliani, M. Murgia, F. C. Matacotta, and S. Barbanera, Solid State Commun. 122, 181 (2002). 10.1016/S0038-1098(02)00090-X
-
(2002)
Solid State Commun.
, vol.122
, pp. 181
-
-
Dediu, V.1
Taliani, C.2
Murgia, M.3
Matacotta, F.C.4
Barbanera, S.5
-
7
-
-
1542319096
-
-
10.1038/nature02325
-
Z. H. Xiong, D. Wu, Z. V. Vardeny, and J. Shi, Nature (London) 427, 821 (2004). 10.1038/nature02325
-
(2004)
Nature (London)
, vol.427
, pp. 821
-
-
Xiong, Z.H.1
Wu, D.2
Vardeny, Z.V.3
Shi, J.4
-
8
-
-
33745214438
-
-
10.1063/1.2213177
-
T. X. Wang, H. X. Wei, Z. M. Zeng, X. F. Han, Z. M. Hong, and G. Q. Shi, Appl. Phys. Lett. 88, 242505 (2006). 10.1063/1.2213177
-
(2006)
Appl. Phys. Lett.
, vol.88
, pp. 242505
-
-
Wang, T.X.1
Wei, H.X.2
Zeng, Z.M.3
Han, X.F.4
Hong, Z.M.5
Shi, G.Q.6
-
9
-
-
0001529685
-
-
10.1103/PhysRevLett.84.2682
-
H. Mehrez, J. Taylor, Hong Guo, J. Wang, and C. Roland, Phys. Rev. Lett. 84, 2682 (2000). 10.1103/PhysRevLett.84.2682
-
(2000)
Phys. Rev. Lett.
, vol.84
, pp. 2682
-
-
Mehrez, H.1
Taylor, J.2
Guo, H.3
Wang, J.4
Roland, C.5
-
10
-
-
0142151585
-
-
10.1103/PhysRevB.68.100407
-
R. Pati, L. Senapati, P. M. Ajayan, and S. K. Nayak, Phys. Rev. B 68, 100407 (R) (2003). 10.1103/PhysRevB.68.100407
-
(2003)
Phys. Rev. B
, vol.68
, pp. 100407
-
-
Pati, R.1
Senapati, L.2
Ajayan, P.M.3
Nayak, S.K.4
-
11
-
-
29644433619
-
-
10.1103/PhysRevB.72.184407;
-
H. Dalgleish and G. Kirczenow, Phys. Rev. B 72, 184407 (2005) 10.1103/PhysRevB.72.184407
-
(2005)
Phys. Rev. B
, vol.72
, pp. 184407
-
-
Dalgleish, H.1
Kirczenow, G.2
-
12
-
-
33745536992
-
-
10.1103/PhysRevB.73.235436
-
H. Dalgleish and G. Kirczenow, Phys. Rev. B 73, 235436 (2006). 10.1103/PhysRevB.73.235436
-
(2006)
Phys. Rev. B
, vol.73
, pp. 235436
-
-
Dalgleish, H.1
Kirczenow, G.2
-
13
-
-
27644550064
-
-
10.1021/nl0513380
-
R. Liu, S. H. Ke, H. U. Baranger, and W. T. Yang, Nano Lett. 5, 1959 (2005). 10.1021/nl0513380
-
(2005)
Nano Lett.
, vol.5
, pp. 1959
-
-
Liu, R.1
Ke, S.H.2
Baranger, H.U.3
Yang, W.T.4
-
14
-
-
16244403960
-
-
10.1038/nmat1349
-
A. R. Rocha, V. M. Garcia-Suarez, S. W. Bailey, C. J. Lambert, J. Ferrer, and S. Sanvito, Nature Mater. 4, 335 (2005). 10.1038/nmat1349
-
(2005)
Nature Mater.
, vol.4
, pp. 335
-
-
Rocha, A.R.1
Garcia-Suarez, V.M.2
Bailey, S.W.3
Lambert, C.J.4
Ferrer, J.5
Sanvito, S.6
-
15
-
-
33646358255
-
-
10.1103/PhysRevLett.96.166804
-
D. Waldron, Paul Haney, Brian Larade, Allan MacDonald, and Hong Guo, Phys. Rev. Lett. 96, 166804 (2006). 10.1103/PhysRevLett.96.166804
-
(2006)
Phys. Rev. Lett.
, vol.96
, pp. 166804
-
-
Waldron, D.1
Haney, P.2
Larade, B.3
MacDonald, A.4
Guo, H.5
-
16
-
-
34347383177
-
-
10.1103/PhysRevB.75.235415
-
Bin Wang, Yu Zhu, Wei Ren, Jian Wang, and Hong Guo, Phys. Rev. B 75, 235415 (2007). 10.1103/PhysRevB.75.235415
-
(2007)
Phys. Rev. B
, vol.75
, pp. 235415
-
-
Wang, B.1
Zhu, Y.2
Ren, W.3
Wang, J.4
Guo, H.5
-
17
-
-
38949204964
-
-
10.1103/PhysRevLett.100.056803
-
Zhannyu Ning, Yu Zhu, Jian Wang, and Hong Guo, Phys. Rev. Lett. 100, 056803 (2008). 10.1103/PhysRevLett.100.056803
-
(2008)
Phys. Rev. Lett.
, vol.100
, pp. 056803
-
-
Ning, Z.1
Zhu, Y.2
Wang, J.3
Guo, H.4
-
18
-
-
1642377815
-
-
10.1088/0953-8984/16/10/L06
-
O. Céspedes, M. S. Ferreira, S. Sanvito, M. Kociak, and J. M. D. Coey, J. Phys.: Condens. Matter 16, L155 (2004). 10.1088/0953-8984/16/10/L06
-
(2004)
J. Phys.: Condens. Matter
, vol.16
, pp. 155
-
-
Céspedes, O.1
Ferreira, M.S.2
Sanvito, S.3
Kociak, M.4
Coey, J.M.D.5
-
19
-
-
0035894201
-
-
10.1103/PhysRevB.64.235111
-
J. Junquera, O. Paz, D. Sanchez-Portal, and E. Artacho, Phys. Rev. B 64, 235111 (2001). 10.1103/PhysRevB.64.235111
-
(2001)
Phys. Rev. B
, vol.64
, pp. 235111
-
-
Junquera, J.1
Paz, O.2
Sanchez-Portal, D.3
Artacho, E.4
-
20
-
-
57149146371
-
-
Relaxation indicates that the bridge and the hollow sites have lowest total energy. In the relaxed structure, the molecule is bonded about 3.5-4.0 off the left lead where the larger absorption distance makes a slightly larger total energy by less than 100 meV. The surface magnetic moment at the Fe or molecule contact is more stable when bond length is varied around 4.0. We therefore fixed the contact distance to be 4.0 throughout the calculations.
-
Relaxation indicates that the bridge and the hollow sites have lowest total energy. In the relaxed structure, the molecule is bonded about 3.5-4.0 off the left lead where the larger absorption distance makes a slightly larger total energy by less than 100 meV. The surface magnetic moment at the Fe or molecule contact is more stable when bond length is varied around 4.0. We therefore fixed the contact distance to be 4.0 throughout the calculations.
-
-
-
-
21
-
-
4243720937
-
-
10.1103/PhysRevB.63.245407;
-
J. Taylor, H. Guo, and J. Wang, Phys. Rev. B 63, 245407 (2001) 10.1103/PhysRevB.63.245407
-
(2001)
Phys. Rev. B
, vol.63
, pp. 245407
-
-
Taylor, J.1
Guo, H.2
Wang, J.3
-
22
-
-
0000512336
-
-
10.1103/PhysRevB.63.121104
-
J. Taylor, H. Guo, and J. Wang, Phys. Rev. B 63, 121104 (2001). 10.1103/PhysRevB.63.121104
-
(2001)
Phys. Rev. B
, vol.63
, pp. 121104
-
-
Taylor, J.1
Guo, H.2
Wang, J.3
-
23
-
-
57149130480
-
-
In NEGF-DFT calculation, the Hamiltonian is converged to 1.0-4 eV. We use a double zeta polarized linear combination of atomic orbitals (LCAO) basis and the exchange correlation is treated at the local spin-density approximation level. As a check to the basis, we confirmed that electronic structures of bulk Fe as well as gas phase molecules N2, CH4, and H2 all well reproduce those obtained from the full potential linearized augmented plane-wave (LAPW) method.
-
In NEGF-DFT calculation, the Hamiltonian is converged to 1.0-4 eV. We use a double zeta polarized linear combination of atomic orbitals (LCAO) basis and the exchange correlation is treated at the local spin-density approximation level. As a check to the basis, we confirmed that electronic structures of bulk Fe as well as gas phase molecules N2, CH4, and H2 all well reproduce those obtained from the full potential linearized augmented plane-wave (LAPW) method.
-
-
-
-
25
-
-
0345550404
-
-
10.1021/nl0346023
-
C. C. Kaun and Hong Guo, Nano Lett. 3, 1521 (2003). 10.1021/nl0346023
-
(2003)
Nano Lett.
, vol.3
, pp. 1521
-
-
Kaun, C.C.1
Guo, H.2
-
26
-
-
10044225881
-
-
10.1038/nmat1256;
-
S. S. P. Parkin, C. Kaiser, A. Panchula, P. M. Rice, B. Hughes, M. Samant, and S. H. Yang, Nature Mater. 3, 862 (2004) 10.1038/nmat1256
-
(2004)
Nature Mater.
, vol.3
, pp. 862
-
-
Parkin, S.S.P.1
Kaiser, C.2
Panchula, A.3
Rice, P.M.4
Hughes, B.5
Samant, M.6
Yang, S.H.7
-
27
-
-
10044257857
-
-
10.1038/nmat1257
-
S. Yuasa, T. Nagahama, A. Fukushima, Y. Suzuki, and K. Ando, Nature Mater. 3, 868 (2004). 10.1038/nmat1257
-
(2004)
Nature Mater.
, vol.3
, pp. 868
-
-
Yuasa, S.1
Nagahama, T.2
Fukushima, A.3
Suzuki, Y.4
Ando, K.5
|