-
2
-
-
0001057536
-
-
10.1103/PhysRevB.55.3456
-
M. B. Kruger, J. H. Nguyen, Y. M. Li, W. A. Caldwell, M. H. Manghnani, and R. Jeanloz, Phys. Rev. B 55, 3456 (1997). 10.1103/PhysRevB.55.3456
-
(1997)
Phys. Rev. B
, vol.55
, pp. 3456
-
-
Kruger, M.B.1
Nguyen, J.H.2
Li, Y.M.3
Caldwell, W.A.4
Manghnani, M.H.5
Jeanloz, R.6
-
4
-
-
79961197724
-
-
10.1103/PhysRevB.84.045308
-
T. A. Pham, T. Li, S. Shankar, F. Gygi, and G. Galli, Phys. Rev. B 84, 045308 (2011). 10.1103/PhysRevB.84.045308
-
(2011)
Phys. Rev. B
, vol.84
, pp. 045308
-
-
Pham, T.A.1
Li, T.2
Shankar, S.3
Gygi, F.4
Galli, G.5
-
5
-
-
0042059097
-
-
10.1103/PhysRevB.41.10727
-
A. Y. Liu and M. L. Cohen, Phys. Rev. B 41, 10727 (1990). 10.1103/PhysRevB.41.10727
-
(1990)
Phys. Rev. B
, vol.41
, pp. 10727
-
-
Liu, A.Y.1
Cohen, M.L.2
-
6
-
-
0000277779
-
-
10.3891/acta.chem.scand.15-1789
-
O. Borgen and H. M. Seip, Acta Chem. Scand. 15, 1789 (1961). 10.3891/acta.chem.scand.15-1789
-
(1961)
Acta Chem. Scand.
, vol.15
, pp. 1789
-
-
Borgen, O.1
Seip, H.M.2
-
8
-
-
0033595185
-
-
10.1038/22493
-
A. Zerr, G. Miehe, G. Serghiou, M. Schwarz, E. Kroke, R. Riedel, H. Fuesz, P. Kroll, and R. Boehler, Nature (London) 400, 340 (1999). 10.1038/22493
-
(1999)
Nature (London)
, vol.400
, pp. 340
-
-
Zerr, A.1
Miehe, G.2
Serghiou, G.3
Schwarz, M.4
Kroke, E.5
Riedel, R.6
Fuesz, H.7
Kroll, P.8
Boehler, R.9
-
9
-
-
34547157571
-
-
10.1063/1.2747214
-
M. Yang, S. J. Wang, Y. P. Feng, G. W. Peng, and Y. Y. Sun, J. Appl. Phys. 102, 013507 (2007). 10.1063/1.2747214
-
(2007)
J. Appl. Phys.
, vol.102
, pp. 013507
-
-
Yang, M.1
Wang, S.J.2
Feng, Y.P.3
Peng, G.W.4
Sun, Y.Y.5
-
10
-
-
0001384651
-
-
10.1103/PhysRevB.61.11979
-
J. Dong, O. F. Sankey, S. K. Deb, G. Wolf, and P. F. McMillan, Phys. Rev. B 61, 11979 (2000). 10.1103/PhysRevB.61.11979
-
(2000)
Phys. Rev. B
, vol.61
, pp. 11979
-
-
Dong, J.1
Sankey, O.F.2
Deb, S.K.3
Wolf, G.4
McMillan, P.F.5
-
11
-
-
0036349379
-
-
10.1111/j.1151-2916.2002.tb00042.x
-
W.-Y. Ching, S.-D. Mo, L. Ouyang, P. Rulis, I. Tanaka, and M. Yoshiya, J. Am. Chem. Soc. 85, 75 (2002). 10.1111/j.1151-2916.2002.tb00042.x
-
(2002)
J. Am. Chem. Soc.
, vol.85
, pp. 75
-
-
Ching, W.-Y.1
Mo, S.-D.2
Ouyang, L.3
Rulis, P.4
Tanaka, I.5
Yoshiya, M.6
-
12
-
-
33144458201
-
-
10.1103/PhysRevB.73.045202
-
W. Y. Ching and P. Rulis, Phys. Rev. B 73, 045202 (2006). 10.1103/PhysRevB.73.045202
-
(2006)
Phys. Rev. B
, vol.73
, pp. 045202
-
-
Ching, W.Y.1
Rulis, P.2
-
13
-
-
0003165354
-
-
10.1103/PhysRevLett.83.5046
-
S.-D. Mo, L. Ouyang, W. Y. Ching, I. Tanaka, Y. Koyama, and R. Riedel, Phys. Rev. Lett. 83, 5046 (1999). 10.1103/PhysRevLett.83.5046
-
(1999)
Phys. Rev. Lett.
, vol.83
, pp. 5046
-
-
Mo, S.-D.1
Ouyang, L.2
Ching, W.Y.3
Tanaka, I.4
Koyama, Y.5
Riedel, R.6
-
15
-
-
84884232694
-
-
10.1103/PhysRevLett.111.097402
-
T. D. Boyko, A. Hunt, A. Zerr, and A. Moewes, Phys. Rev. Lett. 111, 097402 (2013). 10.1103/PhysRevLett.111.097402
-
(2013)
Phys. Rev. Lett.
, vol.111
, pp. 097402
-
-
Boyko, T.D.1
Hunt, A.2
Zerr, A.3
Moewes, A.4
-
16
-
-
78049486399
-
-
10.1103/PhysRevB.82.144112
-
G. K. Pradhan, A. Kumar, S. K. Deb, U. V. Waghmare, and C. Narayana, Phys. Rev. B 82, 144112 (2010). 10.1103/PhysRevB.82.144112
-
(2010)
Phys. Rev. B
, vol.82
, pp. 144112
-
-
Pradhan, G.K.1
Kumar, A.2
Deb, S.K.3
Waghmare, U.V.4
Narayana, C.5
-
18
-
-
0000106245
-
-
10.1002/(SICI)1521-3749(199909) 625:9<1435:: AID-ZAAC1435>3.0.CO;2- #
-
N. Scotti, W. Kockelmann, J. Senker, S. Trael, and H. Jacobs, Z. Anorg. Allg. Chem. 625, 1435 (1999). 10.1002/(SICI)1521-3749(199909)625:9<1435::AID- ZAAC1435>3.0.CO;2-#
-
(1999)
Z. Anorg. Allg. Chem.
, vol.625
, pp. 1435
-
-
Scotti, N.1
Kockelmann, W.2
Senker, J.3
Trael, S.4
Jacobs, H.5
-
19
-
-
0032607475
-
-
10.1063/1.479227
-
G. Serghiou, G. Miehe, O. Tschauner, A. Zerr, and R. Boehler, J. Chem. Phys. 111, 4659 (1999). 10.1063/1.479227
-
(1999)
J. Chem. Phys.
, vol.111
, pp. 4659
-
-
Serghiou, G.1
Miehe, G.2
Tschauner, O.3
Zerr, A.4
Boehler, R.5
-
20
-
-
0035107708
-
-
10.1103/PhysRevB.63.064102
-
W. Y. Ching, S.-D. Mo, I. Tanaka, and M. Yoshiya, Phys. Rev. B 63, 064102 (2001). 10.1103/PhysRevB.63.064102
-
(2001)
Phys. Rev. B
, vol.63
, pp. 064102
-
-
Ching, W.Y.1
Mo, S.-D.2
Tanaka, I.3
Yoshiya, M.4
-
21
-
-
33846068126
-
-
10.1063/1.2402889
-
J. Hu, W. Cheng, S. Huang, D. Wu, and Z. Xie, Appl. Phys. Lett. 89, 261117 (2006). 10.1063/1.2402889
-
(2006)
Appl. Phys. Lett.
, vol.89
, pp. 261117
-
-
Hu, J.1
Cheng, W.2
Huang, S.3
Wu, D.4
Xie, Z.5
-
22
-
-
0042113153
-
-
10.1103/PhysRev.140.A1133
-
W. Kohn and L. J. Sham, Phys. Rev. 140, A1133 (1965). 10.1103/PhysRev.140.A1133
-
(1965)
Phys. Rev.
, vol.140
-
-
Kohn, W.1
Sham, L.J.2
-
23
-
-
26144479723
-
-
10.1103/PhysRevB.12.5536
-
W. Y. Ching and C. C. Lin, Phys. Rev. B 12, 5536 (1975). 10.1103/PhysRevB.12.5536
-
(1975)
Phys. Rev. B
, vol.12
, pp. 5536
-
-
Ching, W.Y.1
Lin, C.C.2
-
24
-
-
36149016819
-
-
10.1103/PhysRev.139.A796
-
L. Hedin, Phys. Rev. 139, A796 (1965). 10.1103/PhysRev.139.A796
-
(1965)
Phys. Rev.
, vol.139
-
-
Hedin, L.1
-
25
-
-
84868210425
-
-
10.1016/j.cpc.2012.09.018
-
H. Jiang, R. I. Gmez-Abal, X.-Z. Li, C. Meisenbichler, C. Ambrosch-Draxl, and M. Scheffler, Comput. Phys. Commun. 184, 348 (2013). 10.1016/j.cpc.2012.09. 018
-
(2013)
Comput. Phys. Commun.
, vol.184
, pp. 348
-
-
Jiang, H.1
Gmez-Abal, R.I.2
Li, X.-Z.3
Meisenbichler, C.4
Ambrosch-Draxl, C.5
Scheffler, M.6
-
27
-
-
70449533121
-
-
10.1016/j.cpc.2009.07.007
-
X. Gonze, B. Amadon, P.-M. Anglade, J.-M. Beuken, F. Bottin, P. Boulanger, F. Bruneval, D. Caliste, R. Caracas, M. Ct et al., Comput. Phys. Commun. 180, 2582 (2009). 10.1016/j.cpc.2009.07.007
-
(2009)
Comput. Phys. Commun.
, vol.180
, pp. 2582
-
-
Gonze, X.1
Amadon, B.2
Anglade, P.-M.3
Beuken, J.-M.4
Bottin, F.5
Boulanger, P.6
Bruneval, F.7
Caliste, D.8
Caracas, R.9
Ct, M.10
-
28
-
-
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
-
-
84856423987
-
-
10.1103/PhysRevB.85.045205
-
G. Kresse, M. Marsman, L. E. Hintzsche, and E. Flage-Larsen, Phys. Rev. B 85, 045205 (2012). 10.1103/PhysRevB.85.045205
-
(2012)
Phys. Rev. B
, vol.85
, pp. 045205
-
-
Kresse, G.1
Marsman, M.2
Hintzsche, L.E.3
Flage-Larsen, E.4
-
32
-
-
84863615819
-
-
10.1016/j.ijhydene.2012.04.138
-
Y. Xu and S.-P. Gao, Int. J. Hydrogen Energy 37, 11072 (2012). 10.1016/j.ijhydene.2012.04.138
-
(2012)
Int. J. Hydrogen Energy
, vol.37
, pp. 11072
-
-
Xu, Y.1
Gao, S.-P.2
-
33
-
-
51649083544
-
-
10.1103/PhysRevLett.101.106404
-
R. Gómez-Abal, X. Li, M. Scheffler, and C. Ambrosch-Draxl, Phys. Rev. Lett. 101, 106404 (2008). 10.1103/PhysRevLett.101.106404
-
(2008)
Phys. Rev. Lett.
, vol.101
, pp. 106404
-
-
Gómez-Abal, R.1
Li, X.2
Scheffler, M.3
Ambrosch-Draxl, C.4
-
34
-
-
84863147039
-
-
10.1088/1367-2630/14/2/023006
-
X.-Z. Li, R. Gmez-Abal, H. Jiang, C. Ambrosch-Draxl, and M. Scheffler, New J. Phys. 14, 023006 (2012). 10.1088/1367-2630/14/2/023006
-
(2012)
New J. Phys.
, vol.14
, pp. 023006
-
-
Li, X.-Z.1
Gmez-Abal, R.2
Jiang, H.3
Ambrosch-Draxl, C.4
Scheffler, M.5
-
35
-
-
0037120381
-
-
10.1103/PhysRevLett.89.126401
-
W. Ku and A. G. Eguiluz, Phys. Rev. Lett. 89, 126401 (2002). 10.1103/PhysRevLett.89.126401
-
(2002)
Phys. Rev. Lett.
, vol.89
, pp. 126401
-
-
Ku, W.1
Eguiluz, A.G.2
-
36
-
-
33745784821
-
-
10.1103/PhysRevB.74.035101
-
M. Shishkin and G. Kresse, Phys. Rev. B 74, 035101 (2006). 10.1103/PhysRevB.74.035101
-
(2006)
Phys. Rev. B
, vol.74
, pp. 035101
-
-
Shishkin, M.1
Kresse, G.2
-
37
-
-
34347372420
-
-
10.1103/PhysRevB.75.235102
-
M. Shishkin and G. Kresse, Phys. Rev. B 75, 235102 (2007). 10.1103/PhysRevB.75.235102
-
(2007)
Phys. Rev. B
, vol.75
, pp. 235102
-
-
Shishkin, M.1
Kresse, G.2
-
41
-
-
0001597302
-
-
10.1103/PhysRevB.47.15931
-
G. E. Engel and B. Farid, Phys. Rev. B 47, 15931 (1993). 10.1103/PhysRevB.47.15931
-
(1993)
Phys. Rev. B
, vol.47
, pp. 15931
-
-
Engel, G.E.1
Farid, B.2
-
42
-
-
43249127492
-
-
10.1103/PhysRevLett.100.186401
-
R. Shaltaf, G.-M. Rignanese, X. Gonze, F. Giustino, and A. Pasquarello, Phys. Rev. Lett. 100, 186401 (2008). 10.1103/PhysRevLett.100.186401
-
(2008)
Phys. Rev. Lett.
, vol.100
, pp. 186401
-
-
Shaltaf, R.1
Rignanese, G.-M.2
Gonze, X.3
Giustino, F.4
Pasquarello, A.5
-
43
-
-
84855388507
-
-
10.1103/PhysRevB.84.241201
-
M. Stankovski, G. Antonius, D. Waroquiers, A. Miglio, H. Dixit, K. Sankaran, M. Giantomassi, X. Gonze, M. Côté, and G.-M. Rignanese, Phys. Rev. B 84, 241201 (2011). 10.1103/PhysRevB.84.241201
-
(2011)
Phys. Rev. B
, vol.84
, pp. 241201
-
-
Stankovski, M.1
Antonius, G.2
Waroquiers, D.3
Miglio, A.4
Dixit, H.5
Sankaran, K.6
Giantomassi, M.7
Gonze, X.8
Côté, M.9
Rignanese, G.-M.10
-
46
-
-
84857613661
-
-
IEEE Computer Society, Washington, DC
-
A. Kozhevnikov, A. G. Eguiluz, and T. C. Schulthess, in SC'10 Proceedings of the 2010 ACM/IEEE International Conference for High Performance Computing, Networking, Storage, and Analysis (IEEE Computer Society, Washington, DC, 2010), pp. 1-10.
-
(2010)
SC'10 Proceedings of the 2010 ACM/IEEE International Conference for High Performance Computing, Networking, Storage, and Analysis
, pp. 1-10
-
-
Kozhevnikov, A.1
Eguiluz, A.G.2
Schulthess, T.C.3
-
47
-
-
84905643238
-
-
See https://code.google.com/p/exciting-plus/ for information about the source code.
-
-
-
-
48
-
-
0037105171
-
-
10.1103/PhysRevB.66.125101
-
M. Usuda, N. Hamada, T. Kotani, and M. van Schilfgaarde, Phys. Rev. B 66, 125101 (2002). 10.1103/PhysRevB.66.125101
-
(2002)
Phys. Rev. B
, vol.66
, pp. 125101
-
-
Usuda, M.1
Hamada, N.2
Kotani, T.3
Van Schilfgaarde, M.4
-
49
-
-
0035504040
-
-
10.1063/1.1407851
-
H. He, T. Sekine, T. Kobayashi, and K. Kimoto, J. Appl. Phys. 90, 4403 (2001). 10.1063/1.1407851
-
(2001)
J. Appl. Phys.
, vol.90
, pp. 4403
-
-
He, H.1
Sekine, T.2
Kobayashi, T.3
Kimoto, K.4
-
50
-
-
77955349310
-
-
10.1103/PhysRevB.81.155207
-
T. D. Boyko, E. Bailey, A. Moewes, and P. F. McMillan, Phys. Rev. B 81, 155207 (2010). 10.1103/PhysRevB.81.155207
-
(2010)
Phys. Rev. B
, vol.81
, pp. 155207
-
-
Boyko, T.D.1
Bailey, E.2
Moewes, A.3
McMillan, P.F.4
-
52
-
-
21844521963
-
-
10.1116/1.579834
-
D. M. Hoffman, S. Prakash Rangarajan, S. D. Athavale, D. J. Economou, J.-R. Liu, Z. Zheng, and W.-K. Chu, J. Vac. Sci. Technol. A 13, 820 (1995). 10.1116/1.579834
-
(1995)
J. Vac. Sci. Technol. A
, vol.13
, pp. 820
-
-
Hoffman, D.M.1
Prakash Rangarajan, S.2
Athavale, S.D.3
Economou, D.J.4
Liu, J.-R.5
Zheng, Z.6
Chu, W.-K.7
|