-
2
-
-
0029360203
-
-
sci SCIEAS 0036-8075
-
N. G. Chopra, R. J. Luyken, K. Cherrey, V. H. Crespi, M. L. Cohen, S. G. Louie, and A. Zettl, Science 269, 966 (1995). sci SCIEAS 0036-8075
-
(1995)
Science
, vol.269
, pp. 966
-
-
Chopra, N.G.1
Luyken, R.J.2
Cherrey, K.3
Crespi, V.H.4
Cohen, M.L.5
Louie, S.G.6
Zettl, A.7
-
3
-
-
0028769665
-
-
sci SCIEAS 0036-8075
-
O. Stephan, P. M. Ajayan, C. Colliex, P. Redlich, J. M. Lambert, P. Bernier, and P. Lefin, Science 266, 1683 (1994). sci SCIEAS 0036-8075
-
(1994)
Science
, vol.266
, pp. 1683
-
-
Stephan, O.1
Ajayan, P.M.2
Colliex, C.3
Redlich, P.4
Lambert, J.M.5
Bernier, P.6
Lefin, P.7
-
4
-
-
0000154676
-
-
prl PRLTAO 0031-9007
-
A. Loiseau, F. Willaime, N. Demoncy, G. Hug, and H. Pascard, Phys. Rev. Lett. 76, 4737 (1996). prl PRLTAO 0031-9007
-
(1996)
Phys. Rev. Lett.
, vol.76
, pp. 4737
-
-
Loiseau, A.1
Willaime, F.2
Demoncy, N.3
Hug, G.4
Pascard, H.5
-
6
-
-
0035883573
-
-
prb PRBMDO 0163-1829
-
R. S. Lee, J. Gavillet, M. L. de la Chapelle, A. Loiseau, J.-L. Cochon, D. Pigache, and J. T. F. Willaime, Phys. Rev. B 64, 121405 (2001). prb PRBMDO 0163-1829
-
(2001)
Phys. Rev. B
, vol.64
, pp. 121405
-
-
Lee, R.S.1
Gavillet, J.2
De La Chapelle, M.L.3
Loiseau, A.4
Cochon, J.-L.5
Pigache, D.6
Willaime, J.T.F.7
-
7
-
-
0000065747
-
-
See for example:, and, apl APPLAB 0003-6951
-
See for example: X. Blase, J. C. Charlier, A. DeVita, and R. Car, Appl. Phys. Lett. 70, 197 (1997). apl APPLAB 0003-6951
-
(1997)
Appl. Phys. Lett.
, vol.70
, pp. 197
-
-
Blase, X.1
Charlier, J.C.2
Devita, A.3
Car, R.4
-
8
-
-
79958219488
-
-
E. J. Mele, P. Král, and D. Tomanek, http://www.aps.org/meet/ MAR01/baps/abs/S8658005.html;
-
-
-
Mele, E.J.1
-
9
-
-
4244101016
-
-
prl PRLTAO 0031-9007
-
Phys. Rev. Lett. 88, 056803 (2002). prl PRLTAO 0031-9007
-
(2002)
Phys. Rev. Lett.
, vol.88
, pp. 056803
-
-
-
11
-
-
79958220135
-
-
S. Nakhmanson, V. Meunier, J. Bernholc, and M. Buongiorno Nardelli (unpublished)
-
S. Nakhmanson, V. Meunier, J. Bernholc, and M. Buongiorno Nardelli (unpublished).
-
-
-
-
12
-
-
0000328286
-
-
The ab initio calculations were carried out via a combination of standard multigrid-based real-space [, and, ; prb PRBMDO 0163-1829
-
The ab initio calculations were carried out via a combination of standard multigrid-based real-space [ E. L. Briggs, D. J. Sullivan, and J. Bernhole, Phys. Rev. B 52, R5471 (1995); prb PRBMDO 0163-1829
-
(1995)
Phys. Rev. B
, vol.52
, pp. 5471
-
-
Briggs, E.L.1
Sullivan, D.J.2
Bernhole, J.3
-
13
-
-
79958241353
-
-
54, 14362 and plane-wave methods After a careful minimization of the atomic coordinates, the structural parameters and electronic band structures obtained were in perfect agreement with those of previous calculations (see Ref. 7)
-
54, 14362 (1996)] and plane-wave methods [S. Baroni et al., http://www.pwscf.org]. After a careful minimization of the atomic coordinates, the structural parameters and electronic band structures obtained were in perfect agreement with those of previous calculations (see Ref. 7).
-
(1996)
-
-
Baroni, S.1
-
14
-
-
79958204204
-
-
In contrast to three-dimensional solids, the asymptotic band offsets of such heterojunctions are conveniently computed from the bulk properties of their isolated components, since the vacuum level (i.e., the ionization potential) may be used as an unequivocal reference energy [R. Resta (private communication)
-
In contrast to three-dimensional solids, the asymptotic band offsets of such heterojunctions are conveniently computed from the bulk properties of their isolated components, since the vacuum level (i.e., the ionization potential) may be used as an unequivocal reference energy [R. Resta (private communication);
-
-
-
-
15
-
-
0001433702
-
-
see also, ]. prb PRBMDO 0163-1829
-
see also L. Kleinman, Phys. Rev. B 24, 7412 (1981)]. prb PRBMDO 0163-1829
-
(1981)
Phys. Rev. B
, vol.24
, pp. 7412
-
-
Kleinman, L.1
-
17
-
-
79958242001
-
-
In 1D systems, the volume of the cell is not relevant to the evaluation of averages and for that reason we have defined the effective volume as being the one in which 99% of the total charge is located (see Ref. 9)
-
In 1D systems, the volume of the cell is not relevant to the evaluation of averages and for that reason we have defined the effective volume as being the one in which 99% of the total charge is located (see Ref. 9).
-
-
-
-
18
-
-
0000400057
-
-
prl PRLTAO 0031-9007
-
M. Posternak, A. Baldereschi, A. Catellani, and R. Resta, Phys. Rev. Lett. 64, 1777 (1990). prl PRLTAO 0031-9007
-
(1990)
Phys. Rev. Lett.
, vol.64
, pp. 1777
-
-
Posternak, M.1
Baldereschi, A.2
Catellani, A.3
Resta, R.4
-
19
-
-
0000584883
-
-
prb PRBMDO 0163-1829
-
C. L. Kane and E. J. Mele, Phys. Rev. B 59, R12759 (1999). prb PRBMDO 0163-1829
-
(1999)
Phys. Rev. B
, vol.59
, pp. 12759
-
-
Kane, C.L.1
Mele, E.J.2
-
21
-
-
0005311621
-
-
prb PRBMDO 0163-1829
-
S. Han and J. Ihm, Phys. Rev. B 61, 9986 (2000). prb PRBMDO 0163-1829
-
(2000)
Phys. Rev. B
, vol.61
, pp. 9986
-
-
Han, S.1
Ihm, J.2
-
22
-
-
2542533439
-
-
A. Maiti, C. Brabec, C. Roland, and J. Bernholc, Phys. Rev. Lett. 73, 2468 (1994); prl PRLTAO 0031-9007
-
(1994)
Phys. Rev. Lett.
, vol.73
, pp. 2468
-
-
Maiti, A.1
Brabec, C.2
Roland, C.3
Bernholc, J.4
-
23
-
-
0001402102
-
-
prb PRBMDO 0163-1829
-
C. Brabec, A. Maiti, C. Roland, and J. Bernholc, Phys. Rev. B 52, 14850 (1995). prb PRBMDO 0163-1829
-
(1995)
Phys. Rev. B
, vol.52
, pp. 14850
-
-
Brabec, C.1
Maiti, A.2
Roland, C.3
Bernholc, J.4
-
24
-
-
0001048838
-
-
We used the so-called dipole correction in order to avoid nondesirable supercell effects and to ensure the flatness of the electrostatic potential in the vacuum [, ]. prb PRBMDO 0163-1829
-
We used the so-called dipole correction in order to avoid nondesirable supercell effects and to ensure the flatness of the electrostatic potential in the vacuum [ L. Bengtsson, Phys. Rev. B 59, 12301 (1999)]. prb PRBMDO 0163-1829
-
(1999)
Phys. Rev. B
, vol.59
, pp. 12301
-
-
Bengtsson, L.1
-
25
-
-
0034883236
-
-
car CRBNAH 0008-6223
-
M. Shiraishi and M. Ata, Carbon 39, 1913 (2001). car CRBNAH 0008-6223
-
(2001)
Carbon
, vol.39
, pp. 1913
-
-
Shiraishi, M.1
Ata, M.2
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