-
1
-
-
84856488239
-
-
The Physical Society, London
-
J. H. E. Griffiths, J. Owen, and I. M. Ward, Report of the Bristol Conference-Defects in Crystalline Solids (The Physical Society, London, 1955), p. 8 1.
-
(1955)
Report of the Bristol Conference-Defects in Crystalline Solids
, pp. 8
-
-
Griffiths, J.H.E.1
Owen, J.2
Ward, I.M.3
-
3
-
-
0024852314
-
ESR and optical characterization of point defects in quartz
-
DOI 10.1016/0883-2889(89)90007-5
-
L. E. Halliburton, Appl. Radiat. Isot. 0883-2889 10.1016/0883-2889(89) 90007-5 40, 859 (1989). (Pubitemid 20071786)
-
(1989)
Applied Radiation and Isotopes
, vol.40
, Issue.10-12
, pp. 859-863
-
-
Halliburton, L.E.1
-
5
-
-
0019064592
-
4.
-
DOI 10.1016/0038-1098(80)91075-3
-
R. H. D. Nuttall and J. Weil, Solid State Commun. SSCOA4 0038-1098 10.1016/0038-1098(80)91075-3 35, 789 (1980). (Pubitemid 11461319)
-
(1980)
Solid State Communications
, vol.35
, Issue.10
, pp. 789-791
-
-
Nattall, R.H.D.1
Weil, J.A.2
-
6
-
-
0000828442
-
-
CJPHAD 0008-4204 10.1139/p81-227
-
R. H. D. Nuttall and J. Weil, Can. J. Phys. CJPHAD 0008-4204 10.1139/p81-227 59, 1696 (1981).
-
(1981)
Can. J. Phys.
, vol.59
, pp. 1696
-
-
Nuttall, R.H.D.1
Weil, J.2
-
7
-
-
0000170322
-
-
SSCOA4 0038-1098 10.1016/0038-1098(76)90975-3
-
O. F. Schirmer, Solid State Commun. SSCOA4 0038-1098 10.1016/0038- 1098(76)90975-3 18, 1349 (1976).
-
(1976)
Solid State Commun.
, vol.18
, pp. 1349
-
-
Schirmer, O.F.1
-
8
-
-
0000793539
-
-
PRBMDO 1098-0121 10.1103/PhysRevB.31.3923
-
F. J. Adrian, A. N. Jette, and J. M. Spaeth, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.31.3923 31, 3923 (1985).
-
(1985)
Phys. Rev. B
, vol.31
, pp. 3923
-
-
Adrian, F.J.1
Jette, A.N.2
Spaeth, J.M.3
-
9
-
-
0001200210
-
-
JCPSA6 0021-9606 10.1063/1.460776
-
F. Sim, C. R. A. Catlow, M. Dupuis, and J. D. Watts, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.460776 95, 4215 (1991).
-
(1991)
J. Chem. Phys.
, vol.95
, pp. 4215
-
-
Sim, F.1
Catlow, C.R.A.2
Dupuis, M.3
Watts, J.D.4
-
10
-
-
0035134711
-
-
PRBMDO 1098-0121 10.1103/PhysRevB.63.054102
-
G. Pacchioni, F. Frigoli, D. Ricci, and J. A. Weil, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.63.054102 63, 054102 (2000).
-
(2000)
Phys. Rev. B
, vol.63
, pp. 054102
-
-
Pacchioni, G.1
Frigoli, F.2
Ricci, D.3
Weil, J.A.4
-
11
-
-
20844438567
-
0 defects in silica materials
-
DOI 10.1063/1.1880972, 144704
-
J. To, A. A. Sokol, S. A. French, N. Kaltsoyannis, and C. R. A. Catlow, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1880972 122, 144704 (2005). (Pubitemid 40858330)
-
(2005)
Journal of Chemical Physics
, vol.122
, Issue.14
, pp. 1-13
-
-
To, J.1
Sokol, A.A.2
French, S.A.3
Kaltsoyannis, N.4
Catlow, C.R.A.5
-
12
-
-
0000918347
-
-
PRBMDO 1098-0121 10.1103/PhysRevB.54.13687
-
A. Continenza and A. DiPomponio, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.54.13687 54, 13687 (1996).
-
(1996)
Phys. Rev. B
, vol.54
, pp. 13687
-
-
Continenza, A.1
Dipomponio, A.2
-
13
-
-
0001350786
-
-
PRBMDO 1098-0121 10.1103/PhysRevB.61.12590
-
J. Laegsgaard and K. Stokbro, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.61.12590 61, 12590 (2000).
-
(2000)
Phys. Rev. B
, vol.61
, pp. 12590
-
-
Laegsgaard, J.1
Stokbro, K.2
-
14
-
-
68749106021
-
-
PRLTAO 0031-9007 10.1103/PhysRevLett.103.016404
-
J. A. Chan, S. Lany, and A. Zunger, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.103.016404 103, 016404 (2009).
-
(2009)
Phys. Rev. Lett.
, vol.103
, pp. 016404
-
-
Chan, J.A.1
Lany, S.2
Zunger, A.3
-
15
-
-
77954965064
-
-
PRBMDO 1098-0121 10.1103/PhysRevB.81.115311
-
S. J. Clark, J. Robertson, S. Lany, and A. Zunger, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.81.115311 81, 115311 (2010).
-
(2010)
Phys. Rev. B
, vol.81
, pp. 115311
-
-
Clark, S.J.1
Robertson, J.2
Lany, S.3
Zunger, A.4
-
16
-
-
77954721047
-
-
PRBMDO 1098-0121 10.1103/PhysRevB.80.195205
-
A. Carvalho, A. Alkauskas, A. Pasquarello, A. K. Tagantsev, and N. Setter, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.80.195205 80, 195205 (2009).
-
(2009)
Phys. Rev. B
, vol.80
, pp. 195205
-
-
Carvalho, A.1
Alkauskas, A.2
Pasquarello, A.3
Tagantsev, A.K.4
Setter, N.5
-
17
-
-
79958027008
-
-
MIENEF 0167-9317 10.1016/j.mee.2011.03.078
-
S. J. Clark, L. Lin, and J. Robertson, Microelec. Eng. MIENEF 0167-9317 10.1016/j.mee.2011.03.078 88, 1464 (2011).
-
(2011)
Microelec. Eng.
, vol.88
, pp. 1464
-
-
Clark, S.J.1
Lin, L.2
Robertson, J.3
-
18
-
-
79959405955
-
-
PRBMDO 1098-0121 10.1103/PhysRevB.83.155207
-
P. Deak, B. Aradi, and T. Frauenheim, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.83.155207 83, 155207 (2011).
-
(2011)
Phys. Rev. B
, vol.83
, pp. 155207
-
-
Deak, P.1
Aradi, B.2
Frauenheim, T.3
-
19
-
-
77951183880
-
-
APPLAB 0003-6951 10.1063/1.3383236
-
S. Lany and A. Zunger, Appl. Phys. Lett. APPLAB 0003-6951 10.1063/1.3383236 96, 142114 (2010).
-
(2010)
Appl. Phys. Lett.
, vol.96
, pp. 142114
-
-
Lany, S.1
Zunger, A.2
-
20
-
-
70349472607
-
-
PRBMDO 1098-0121 10.1103/PhysRevB.80.085202
-
S. Lany and A. Zunger, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.80. 085202 80, 085202 (2009).
-
(2009)
Phys. Rev. B
, vol.80
, pp. 085202
-
-
Lany, S.1
Zunger, A.2
-
21
-
-
49449097052
-
-
SCIEAS 0036-8075 10.1126/science.1158722
-
A. J. Cohen, P. Mori-Sanchez, and W. Yang, Science SCIEAS 0036-8075 10.1126/science.1158722 321, 792 (2008).
-
(2008)
Science
, vol.321
, pp. 792
-
-
Cohen, A.J.1
Mori-Sanchez, P.2
Yang, W.3
-
22
-
-
33344469727
-
Density functional theory description of hole-trapping in Si O2: A self-interaction-corrected approach
-
DOI 10.1103/PhysRevB.71.205210
-
M. d'Avezac, M. Calandra, and F. Mauri, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.71.205210 71, 205210 (2005). (Pubitemid 43285187)
-
(2005)
Physical Review B - Condensed Matter and Materials Physics
, vol.71
, Issue.20
, pp. 205210
-
-
D'Avezac, M.1
Calandra, M.2
Mauri, F.3
-
23
-
-
26144450583
-
-
PRBMDO 1098-0121 10.1103/PhysRevB.23.5048
-
J. P. Perdew and A. Zunger, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.23.5048 23, 5048 (1981).
-
(1981)
Phys. Rev. B
, vol.23
, pp. 5048
-
-
Perdew, J.P.1
Zunger, A.2
-
24
-
-
0035952915
-
Hole trapping at Al impurities in silica: A challenge for density functional theories
-
DOI 10.1103/PhysRevLett.86.2834
-
J. Lægsgaard and K. Stokbro, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.86.2834 86, 2834 (2001). (Pubitemid 32293398)
-
(2001)
Physical Review Letters
, vol.86
, Issue.13
, pp. 2834-2837
-
-
Laegsgaard, J.1
Stokbro, K.2
-
25
-
-
0001696531
-
-
PRBMDO 1098-0121 10.1103/PhysRevB.41.7868
-
D. M. Bylander and L. Kleinman, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.41.7868 41, 7868 (1990).
-
(1990)
Phys. Rev. B
, vol.41
, pp. 7868
-
-
Bylander, D.M.1
Kleinman, L.2
-
26
-
-
0001388602
-
-
PRBMDO 1098-0121 10.1103/PhysRevB.53.3764
-
A. Seidl, A. Görling, P. Vogl, J. A. Majewski, and M. Levy, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.53.3764 53, 3764 (1996).
-
(1996)
Phys. Rev. B
, vol.53
, pp. 3764
-
-
Seidl, A.1
Görling, A.2
Vogl, P.3
Majewski, J.A.4
Levy, M.5
-
27
-
-
77954965064
-
-
PRBMDO 1098-0121 10.1103/PhysRevB.81.115311
-
S. J. Clark, J. Robertson, S. Lany, and A. Zunger, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.81.115311 81, 115311 (2010).
-
(2010)
Phys. Rev. B
, vol.81
, pp. 115311
-
-
Clark, S.J.1
Robertson, J.2
Lany, S.3
Zunger, A.4
-
28
-
-
77957592172
-
-
PRBMDO 1098-0121 10.1103/PhysRevB.82.085208
-
S. J. Clark and J. Robertson, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.82.085208 82, 085208 (2010).
-
(2010)
Phys. Rev. B
, vol.82
, pp. 085208
-
-
Clark, S.J.1
Robertson, J.2
-
29
-
-
20144380685
-
First principles methods using CASTEP
-
DOI 10.1524/zkri.220.5.567.65075
-
S. J. Clark, M. D. Segall, C. J. Pickard, P. J. Hasnip, M. J. Probert, K. Refson, and M. C. Payne, Z. Kristallogr. ZEKRDZ 0044-2968 10.1524/zkri.220.5. 567.65075 220, 567 (2005). (Pubitemid 40778242)
-
(2005)
Zeitschrift fur Kristallographie
, vol.220
, Issue.5-6
, pp. 567-570
-
-
Clark, S.J.1
Segall, M.D.2
Pickard, C.J.3
Hasnip, P.J.4
Probert, M.I.J.5
Refson, K.6
Payne, M.C.7
-
31
-
-
33845518500
-
Influence of the exchange screening parameter on the performance of screened hybrid functionals
-
DOI 10.1063/1.2404663
-
A. V. Krukau, O. A. Vydrov, A. F. Izmaylov, and G. E. Scuseria, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.2404663 125, 224106 (2006). (Pubitemid 44927407)
-
(2006)
Journal of Chemical Physics
, vol.125
, Issue.22
, pp. 224106
-
-
Krukau, A.V.1
Vydrov, O.A.2
Izmaylov, A.F.3
Scuseria, G.E.4
-
32
-
-
0000198608
-
-
PRBMDO 1098-0121 10.1103/PhysRevB.7.5212
-
A. Baldereschi, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.7.5212 7, 5212 (1973).
-
(1973)
Phys. Rev. B
, vol.7
, pp. 5212
-
-
Baldereschi, A.1
-
33
-
-
84856484427
-
-
[http://opium.sourceforge.net/];
-
-
-
-
34
-
-
0001666575
-
-
PRBMDO 1098-0121 10.1103/PhysRevB.59.12471
-
N. J. Ramer and A. M. Rappe, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.59.12471 59, 12471 (1999).
-
(1999)
Phys. Rev. B
, vol.59
, pp. 12471
-
-
Ramer, N.J.1
Rappe, A.M.2
-
36
-
-
84856417543
-
-
[http://www.thch.uni-bonn.de/tc/orca/].
-
-
-
-
37
-
-
26244461462
-
Balanced basis sets of split valence, triple zeta valence and quadruple zeta valence quality for H to Rn: Design and assessment of accuracy
-
DOI 10.1039/b508541a
-
F. Weigend and R. Ahlrichs, Phys. Chem. Chem. Phys. PPCPFQ 1463-9076 10.1039/b508541a 7, 3297 (2005). (Pubitemid 41412231)
-
(2005)
Physical Chemistry Chemical Physics
, vol.7
, Issue.18
, pp. 3297-3305
-
-
Weigend, F.1
Ahlrichs, R.2
-
39
-
-
34250817103
-
-
JCPSA6 0021-9606 10.1063/1.464304
-
A. D. Becke, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.464304 98, 1372 (1993).
-
(1993)
J. Chem. Phys.
, vol.98
, pp. 1372
-
-
Becke, A.D.1
-
40
-
-
0019073957
-
2: Optical absorption of the aluminum-associated hole center
-
DOI 10.1063/1.327471
-
N. Koumvakalis, J. Appl. Phys. JAPIAU 0021-8979 10.1063/1.327471 51, 5528 (1980). (Pubitemid 11465378)
-
(1980)
Journal of Applied Physics
, vol.51
, Issue.10
, pp. 5528-5532
-
-
Koumvakalis Nicholas1
|