-
1
-
-
0035884549
-
-
10.1103/PhysRevB.64.115108
-
N. V. Skorodumova, R. Ahuja, S. I. Simak, I. A. Abrikosov, B. Johansson, and B. I. Lundqvist, Phys. Rev. B 64, 115108 (2001). 10.1103/PhysRevB.64.115108
-
(2001)
Phys. Rev. B
, vol.64
, pp. 115108
-
-
Skorodumova, N.V.1
Ahuja, R.2
Simak, S.I.3
Abrikosov, I.A.4
Johansson, B.5
Lundqvist, B.I.6
-
2
-
-
0035891408
-
Alternative energy technologies
-
DOI 10.1038/35104599
-
M. S. Dresselhaus and I. L. Thomas, Nature (London) 414, 332 (2001). 10.1038/35104599 (Pubitemid 33097815)
-
(2001)
Nature
, vol.414
, Issue.6861
, pp. 332-337
-
-
Dresselhaus, M.S.1
Thomas, I.L.2
-
3
-
-
36549099028
-
-
10.1063/1.103202
-
T. Inoue, Y. Yamamoto, S. Koyama, S. Suzuki, and Y. Ueda, Appl. Phys. Lett. 56, 1332 (1990). 10.1063/1.103202
-
(1990)
Appl. Phys. Lett.
, vol.56
, pp. 1332
-
-
Inoue, T.1
Yamamoto, Y.2
Koyama, S.3
Suzuki, S.4
Ueda, Y.5
-
4
-
-
33847518503
-
-
10.1063/1.106126
-
L. Luo, X. D. Wu, R. C. Dye, R. E. Muenchausen, S. R. Foltyn, Y. Coulter, C. J. Maggiore, and T. Inoue, Appl. Phys. Lett. 59, 2043 (1991). 10.1063/1.106126
-
(1991)
Appl. Phys. Lett.
, vol.59
, pp. 2043
-
-
Luo, L.1
Wu, X.D.2
Dye, R.C.3
Muenchausen, R.E.4
Foltyn, S.R.5
Coulter, Y.6
Maggiore, C.J.7
Inoue, T.8
-
5
-
-
33847297945
-
2 from first principles
-
DOI 10.1016/j.jnucmat.2006.11.003, PII S0022311506005824
-
I. R. Shein, K. I. Shein, and A. L. Ivanovskii, J. Nucl. Mater. 361, 69 (2007). 10.1016/j.jnucmat.2006.11.003 (Pubitemid 46330390)
-
(2007)
Journal of Nuclear Materials
, vol.361
, Issue.1
, pp. 69-77
-
-
Shein, I.R.1
Shein, K.I.2
Ivanovskii, A.L.3
-
6
-
-
0035478733
-
2 pellets
-
DOI 10.1016/S0022-3115(01)00655-9, PII S0022311501006559
-
Y. Altaş and H. Tel, J. Nucl. Mater. 298, 316 (2001). 10.1016/S0022-3115(01)00655-9 (Pubitemid 32903669)
-
(2001)
Journal of Nuclear Materials
, vol.298
, Issue.3
, pp. 316-320
-
-
Altas, Y.1
Tel, H.2
-
7
-
-
4344593982
-
-
10.1111/j.1151-2916.2004.tb07717-33.x
-
N. I. Santha, M. T. Sebastian, P. Mohanan, N. M. Alford, R. C. Sarma, K. Pullar, S. Kamba, A. Pashkin, P. Samukhina, and J. Petzelt, J. Am. Ceram. Soc. 87, 1233 (2004). 10.1111/j.1151-2916.2004.tb07717-33.x
-
(2004)
J. Am. Ceram. Soc.
, vol.87
, pp. 1233
-
-
Santha, N.I.1
Sebastian, M.T.2
Mohanan, P.3
Alford, N.M.4
Sarma, R.C.5
Pullar, K.6
Kamba, S.7
Pashkin, A.8
Samukhina, P.9
Petzelt, J.10
-
10
-
-
0035254378
-
2 nanometer thin films
-
DOI 10.1016/S0254-0584(00)00357-6
-
S. Wang, J. Wang, W. Zuo, and Y. Qian, Mater. Chem. Phys. 68, 246 (2001). 10.1016/S0254-0584(00)00357-6 (Pubitemid 32077257)
-
(2001)
Materials Chemistry and Physics
, vol.68
, Issue.1-3
, pp. 246-248
-
-
Wang, S.1
Wang, W.2
Zuo, J.3
Qian, Y.4
-
11
-
-
0036643866
-
-
I. Kosacki, T. Suzuki, H. U. Anderson, and P. Colomban, Solid State Ionics 149, 99 (2002).
-
(2002)
Solid State Ionics
, vol.149
, pp. 99
-
-
Kosacki, I.1
Suzuki, T.2
Anderson, H.U.3
Colomban, P.4
-
12
-
-
0007798924
-
-
10.1039/f29878301109
-
K. Clausen, W. Hayes, E. J. Macdonald, R. Osborn, and G. P. Schnabel, J. Chem. Soc., Faraday Trans. 2 83, 1109 (1987). 10.1039/f29878301109
-
(1987)
J. Chem. Soc., Faraday Trans. 2
, vol.83
, pp. 1109
-
-
Clausen, K.1
Hayes, W.2
MacDonald, E.J.3
Osborn, R.4
Schnabel, G.P.5
-
16
-
-
4944239472
-
-
10.1016/j.jallcom.2004.04.099
-
S. J. Olsen, L. Gerward, V. Kanchana, and G. Vaitheeswaran, J. Alloys Compd. 381, 37 (2004). 10.1016/j.jallcom.2004.04.099
-
(2004)
J. Alloys Compd.
, vol.381
, pp. 37
-
-
Olsen, S.J.1
Gerward, L.2
Kanchana, V.3
Vaitheeswaran, G.4
-
17
-
-
0001286270
-
-
10.1080/08957959008203190
-
J. P. Dancausse, E. Gering, S. Heathman, and U. Benedict, High Press. Res. 2, 381 (1990). 10.1080/08957959008203190
-
(1990)
High Press. Res.
, vol.2
, pp. 381
-
-
Dancausse, J.P.1
Gering, E.2
Heathman, S.3
Benedict, U.4
-
18
-
-
37649026777
-
-
10.1103/PhysRevB.70.014113
-
M. Idiri, T. Le Bihan, S. Heathman, and J. Rebizant, Phys. Rev. B 70, 014113 (2004). 10.1103/PhysRevB.70.014113
-
(2004)
Phys. Rev. B
, vol.70
, pp. 014113
-
-
Idiri, M.1
Le Bihan, T.2
Heathman, S.3
Rebizant, J.4
-
19
-
-
29544451931
-
-
10.1103/PhysRevB.38.7755
-
S. J. Duclos, Y. K. Vohra, A. L. Ruoff, A. Jayaraman, and G. P. Espinosa, Phys. Rev. B 38, 7755 (1988). 10.1103/PhysRevB.38.7755
-
(1988)
Phys. Rev. B
, vol.38
, pp. 7755
-
-
Duclos, S.J.1
Vohra, Y.K.2
Ruoff, A.L.3
Jayaraman, A.4
Espinosa, G.P.5
-
20
-
-
33750575222
-
2
-
DOI 10.1088/0953-8984/18/42/008, PII S095389840623875X, 008
-
V. Kanchana, G. Vaitheeswaran, A. Svane, and A. Delin, J. Phys.: Condens. Matter 18, 9615 (2006). 10.1088/0953-8984/18/42/008 (Pubitemid 44679518)
-
(2006)
Journal of Physics Condensed Matter
, vol.18
, Issue.42
, pp. 9615-9624
-
-
Kanchana, V.1
Vaitheeswaran, G.2
Svane, A.3
Delin, A.4
-
23
-
-
0347371661
-
High pressure theoretical studies of actinide dioxides
-
DOI 10.1080/08957950212818
-
S. Li, R. Ahuja, and B. Johansson, High Press. Res. 22, 471 (2002). 10.1080/08957950212818 (Pubitemid 135706984)
-
(2002)
High Pressure Research
, vol.22
, Issue.2
, pp. 471-474
-
-
Li, S.A.1
Ahuja, R.2
Johansson, B.3
-
24
-
-
14644435835
-
2 (X = Zr, Hf and Th) in fluorite phase
-
DOI 10.1016/j.commatsci.2004.12.059, PII S0927025604003374, Proceedings of the E-MRS 2004 Spring Meeting: Symposium H: Atomic materials Design: Modelling and Characterization
-
R. Terki, G. Feraoun, H. Bertrand, and H. Aourag, Comput. Mater. Sci. 33, 44 (2005). 10.1016/j.commatsci.2004.12.059 (Pubitemid 40319656)
-
(2005)
Computational Materials Science
, vol.33
, Issue.1-3
, pp. 44-52
-
-
Terki, R.1
Feraoun, H.2
Bertrand, G.3
Aourag, H.4
-
25
-
-
0000428112
-
-
10.1103/PhysRevB.4.2701
-
E. T. Rodine and P. L. Land, Phys. Rev. B 4, 2701 (1971). 10.1103/PhysRevB.4.2701
-
(1971)
Phys. Rev. B
, vol.4
, pp. 2701
-
-
Rodine, E.T.1
Land, P.L.2
-
27
-
-
29744459409
-
First-principles study of rare-earth oxides
-
DOI 10.1103/PhysRevB.72.205118, 205118
-
L. Petit, A. Svane, Z. Szotek, and W. M. Temmerman, Phys. Rev. B 72, 205118 (2005). 10.1103/PhysRevB.72.205118 (Pubitemid 43029444)
-
(2005)
Physical Review B - Condensed Matter and Materials Physics
, vol.72
, Issue.20
, pp. 1-9
-
-
Petit, L.1
Svane, A.2
Szotek, Z.3
Temmerman, W.M.4
-
28
-
-
23844488426
-
2 - An experimental and theoretical study
-
DOI 10.1016/j.jallcom.2005.04.008, PII S0925838805003403
-
L. Gerward, S. J. Olsen, V. Kanchana, G. Vaitheeswaran, and A. Svane, J. Alloys Compd. 400, 56 (2005). 10.1016/j.jallcom.2005.04.008 (Pubitemid 41165423)
-
(2005)
Journal of Alloys and Compounds
, vol.400
, Issue.1-2
, pp. 56-61
-
-
Gerward, L.1
Staun Olsen, J.2
Petit, L.3
Vaitheeswaran, G.4
Kanchana, V.5
Svane, A.6
-
29
-
-
0032970594
-
-
10.1002/(SICI)1521-3765(19990201)5:2<515::AID-CHEM515>3.0.CO;2-Y
-
G. A. Landrum, R. Dronskowski, R. Niewa, and F. J. DiSalvo, Chem.-Eur. J. 5, 515 (1999). 10.1002/(SICI)1521-3765(19990201)5:2<515::AID-CHEM515>3.0. CO;2-Y
-
(1999)
Chem.-Eur. J.
, vol.5
, pp. 515
-
-
Landrum, G.A.1
Dronskowski, R.2
Niewa, R.3
Disalvo, F.J.4
-
30
-
-
0020781771
-
2.
-
DOI 10.1016/0038-1098(83)90550-1
-
D. D. Koelling, A. M. Boring, and J. H. Wood, Solid State Commun. 47, 227 (1983). 10.1016/0038-1098(83)90550-1 (Pubitemid 13571351)
-
(1983)
Solid State Communications
, vol.47
, Issue.4
, pp. 227-232
-
-
Koelling, D.D.1
Boring, A.M.2
Wood, J.H.3
-
31
-
-
15744369247
-
Taming multiple valency with density functionals: A case study of defective ceria
-
DOI 10.1103/PhysRevB.71.041102, 041102
-
S. Fabris, S. de Gironcoli, S. Baroni, G. Vicario, and G. Balducci, Phys. Rev. B 71, 041102 (R) (2005). 10.1103/PhysRevB.71.041102 (Pubitemid 40418036)
-
(2005)
Physical Review B - Condensed Matter and Materials Physics
, vol.71
, Issue.4
, pp. 1-4
-
-
Fabris, S.1
De Gironcoli, S.2
Baroni, S.3
Vicario, G.4
Balducci, G.5
-
32
-
-
0034428129
-
Structural properties of lanthanide and actinide compounds within the plane wave pseudopotential approach
-
DOI 10.1103/PhysRevLett.85.5122
-
C. J. Pickard, B. Winkler, R. K. Chen, M. C. Payne, M. H. Lee, J. S. Lin, J. A. White, V. Milman, and D. Vanderbilt, Phys. Rev. Lett. 85, 5122 (2000). 10.1103/PhysRevLett.85.5122 (Pubitemid 32871789)
-
(2000)
Physical Review Letters
, vol.85
, Issue.24
, pp. 5122-5125
-
-
Pickard, C.J.1
Winkler, B.2
Chen, R.K.3
Payne, M.C.4
Lee, M.H.5
Lin, J.S.6
White, J.A.7
Milman, V.8
Vanderbilt, D.9
-
33
-
-
21844448357
-
-
10.1016/j.tsf.2004.11.240
-
T. Yamamoto, T. Uda, T. Hamada, H. Momida, and T. Ohno, Thin Solid Films 486, 136 (2005). 10.1016/j.tsf.2004.11.240
-
(2005)
Thin Solid Films
, vol.486
, pp. 136
-
-
Yamamoto, T.1
Uda, T.2
Hamada, T.3
Momida, H.4
Ohno, T.5
-
34
-
-
24144432327
-
2 surfaces and prediction of effects of oxygen partial pressure and temperature on stabilities
-
DOI 10.1063/1.1949189, 064701
-
Y. Jiang, J. B. Adams, and M. van Schilfgaarde, J. Chem. Phys. 123, 064701 (2005). 10.1063/1.1949189 (Pubitemid 41231997)
-
(2005)
Journal of Chemical Physics
, vol.123
, Issue.6
, pp. 1-9
-
-
Jiang, Y.1
Adams, J.B.2
Van Schilfgaarde, M.3
-
35
-
-
0037078667
-
-
10.1103/PhysRevLett.89.166601
-
N. V. Skorodumova, S. I. Simak, B. I. Lundqvist, I. A. Abrikosov, and B. Johansson, Phys. Rev. Lett. 89, 166601 (2002). 10.1103/PhysRevLett.89.166601
-
(2002)
Phys. Rev. Lett.
, vol.89
, pp. 166601
-
-
Skorodumova, N.V.1
Simak, S.I.2
Lundqvist, B.I.3
Abrikosov, I.A.4
Johansson, B.5
-
36
-
-
33846396206
-
-
10.1103/PhysRevB.75.035115
-
C. Loschen, J. Carrasco, K. M. Neyman, and F. Illas, Phys. Rev. B 75, 035115 (2007). 10.1103/PhysRevB.75.035115
-
(2007)
Phys. Rev. B
, vol.75
, pp. 035115
-
-
Loschen, C.1
Carrasco, J.2
Neyman, K.M.3
Illas, F.4
-
37
-
-
33846454331
-
-
10.1103/PhysRevB.75.045121
-
J. L. F. Da Silva, M. V. Ganduglia-Pirovano, J. Sauer, V. Bayer, and G. Kresse, Phys. Rev. B 75, 045121 (2007). 10.1103/PhysRevB.75.045121
-
(2007)
Phys. Rev. B
, vol.75
, pp. 045121
-
-
Da Silva, J.L.F.1
Ganduglia-Pirovano, M.V.2
Sauer, J.3
Bayer, V.4
Kresse, G.5
-
41
-
-
12544258992
-
Density functional theory studies of the structure and electronic structure of pure and defective low index surfaces of ceria
-
DOI 10.1016/j.susc.2004.12.016, PII S0039602804015651
-
M. Nolan, S. Grigoleit, D. C. Sayle, S. C. Parker, and G. W. Watson, Surf. Sci. 576, 217 (2005). 10.1016/j.susc.2004.12.016 (Pubitemid 40151919)
-
(2005)
Surface Science
, vol.576
, Issue.1-3
, pp. 217-229
-
-
Nolan, M.1
Grigoleit, S.2
Sayle, D.C.3
Parker, S.C.4
Watson, G.W.5
-
42
-
-
21244471846
-
-
Cambridge University Press, Cambridge, England
-
R. M. Martin, Electronic Structure (Cambridge University Press, Cambridge, England, 2004).
-
(2004)
Electronic Structure
-
-
Martin, R.M.1
-
43
-
-
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
-
44
-
-
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
-
45
-
-
12844286241
-
-
10.1103/PhysRevB.47.558
-
G. Kresse and J. Hafner, Phys. Rev. B 47, 558 (1993). 10.1103/PhysRevB.47.558
-
(1993)
Phys. Rev. B
, vol.47
, pp. 558
-
-
Kresse, G.1
Hafner, J.2
-
48
-
-
0001486791
-
-
10.1103/PhysRevB.57.1505
-
S. L. Dudarev, G. A. Botton, S. Y. Savrasov, C. J. Humphreys, and A. P. Sutton, Phys. Rev. B 57, 1505 (1998). 10.1103/PhysRevB.57.1505
-
(1998)
Phys. Rev. B
, vol.57
, pp. 1505
-
-
Dudarev, S.L.1
Botton, G.A.2
Savrasov, S.Y.3
Humphreys, C.J.4
Sutton, A.P.5
-
49
-
-
0000409264
-
-
10.1029/JB092iB09p09319
-
P. Vinet, J. Ferrante, J. H. Rose, and J. R. Smith, J. Geophys. Res. 92, 9319 (1987). 10.1029/JB092iB09p09319
-
(1987)
J. Geophys. Res.
, vol.92
, pp. 9319
-
-
Vinet, P.1
Ferrante, J.2
Rose, J.H.3
Smith, J.R.4
-
50
-
-
54849415525
-
-
10.1002/pssa.200776453
-
S. Özdemir Kart, M. Uludogan, I. Karaman, and T. Cagin, Phys. Status Solidi A 205, 1026 (2008). 10.1002/pssa.200776453
-
(2008)
Phys. Status Solidi A
, vol.205
, pp. 1026
-
-
Özdemir Kart, S.1
Uludogan, M.2
Karaman, I.3
Cagin, T.4
-
53
-
-
36649026155
-
-
10.1103/PhysRevB.76.193108
-
J. L. F. Da Silva, Phys. Rev. B 76, 193108 (2007). 10.1103/PhysRevB.76. 193108
-
(2007)
Phys. Rev. B
, vol.76
, pp. 193108
-
-
Da Silva, J.L.F.1
-
54
-
-
29444460327
-
Electronic and atomistic structures of clean and reduced ceria surfaces
-
DOI 10.1021/jp0511698
-
S. Fabris, G. Vicario, G. Balducci, S. deGironcoli, and S. Baroni, J. Phys. Chem. B 109, 22860 (2005). 10.1021/jp0511698 (Pubitemid 43010713)
-
(2005)
Journal of Physical Chemistry B
, vol.109
, Issue.48
, pp. 22860-22867
-
-
Fabris, S.1
Vicario, G.2
Balducci, G.3
De Gironcoli, S.4
Baroni, S.5
-
56
-
-
0000568783
-
-
10.1103/PhysRevLett.53.202
-
E. Wuilloud, B. Delley, W. D. Schneider, and Y. Baer, Phys. Rev. Lett. 53, 202 (1984). 10.1103/PhysRevLett.53.202
-
(1984)
Phys. Rev. Lett.
, vol.53
, pp. 202
-
-
Wuilloud, E.1
Delley, B.2
Schneider, W.D.3
Baer, Y.4
-
57
-
-
0000283798
-
-
10.1103/PhysRevB.60.1460
-
Z. Hu, R. Meier, C. Schüßler-Langeheine, E. Weschke, G. Kaindl, I. Felner, M. Merz, N. Nücker, S. Schuppler, and A. Erb, Phys. Rev. B 60, 1460 (1999). 10.1103/PhysRevB.60.1460
-
(1999)
Phys. Rev. B
, vol.60
, pp. 1460
-
-
Hu, Z.1
Meier, R.2
Schüßler-Langeheine, C.3
Weschke, E.4
Kaindl, G.5
Felner, I.6
Merz, M.7
Nücker, N.8
Schuppler, S.9
Erb, A.10
|