-
4
-
-
0001666938
-
-
10.1103/PhysRevB.51.6773 0163-1829 B
-
de Gironcoli S 1995 Phys. Rev. B 51 6773
-
(1995)
Phys. Rev.
, vol.51
, Issue.10
, pp. 6773
-
-
De Gironcoli, S.1
-
6
-
-
0001231112
-
-
10.1103/PhysRevB.60.R3709 0163-1829 B
-
Heid R and Bohnen K-P 1999 Phys. Rev. B 60 R3709
-
(1999)
Phys. Rev.
, vol.60
, Issue.6
, pp. 3709
-
-
Heid, R.1
Bohnen, K.-P.2
-
9
-
-
0000458143
-
-
10.1103/PhysRevB.60.11427 0163-1829 B
-
Favot F and Dal Corso A 1999 Phys. Rev. B 60 11427
-
(1999)
Phys. Rev.
, vol.60
, Issue.16
, pp. 11427
-
-
Favot, F.1
Dal Corso, A.2
-
15
-
-
24544438948
-
-
10.1103/PhysRevB.49.3226 0163-1829 B
-
Quong A A 1994 Phys. Rev. B 49 3226
-
(1994)
Phys. Rev.
, vol.49
, Issue.5
, pp. 3226
-
-
Quong, A.A.1
-
16
-
-
34548205281
-
-
10.1103/PhysRevB.76.054308 1098-0121 B 054308
-
Dal Corso A 2007 Phys. Rev. B 76 054308
-
(2007)
Phys. Rev.
, vol.76
, Issue.5
-
-
Dal Corso, A.1
-
17
-
-
8344242162
-
-
10.1002/jcc.20120 0192-8651
-
Zicovich-Wilson C M, Pascale F, Roetti C, Saunders V R, Orlando R and Dovesi R 2004 J. Comput. Chem. 25 1873
-
(2004)
J. Comput. Chem.
, vol.25
, Issue.15
, pp. 1873
-
-
Zicovich-Wilson, C.M.1
Pascale, F.2
Roetti, C.3
Saunders, V.R.4
Orlando, R.5
Dovesi, R.6
-
23
-
-
41849095114
-
Restoring the density-gradient expansion for exchange in solids and surfaces
-
DOI 10.1103/PhysRevLett.100.136406
-
Perdew J P, Ruzsinszky A, Csonka G I, Vydrov O A, Scuseria G E, Constantin L A, Zhou X and Burke K 2008 Phys. Rev. Lett. 100 136406 (Pubitemid 351503187)
-
(2008)
Physical Review Letters
, vol.100
, Issue.13
, pp. 136406
-
-
Perdew, J.P.1
Ruzsinszky, A.2
Csonka, G.I.3
Vydrov, O.A.4
Scuseria, G.E.5
Constantin, L.A.6
Zhou, X.7
Burke, K.8
-
24
-
-
57149136361
-
-
10.1103/PhysRevB.78.197101 1098-0121 B 197101
-
Zhao Y and Truhlar D G 2008 Phys. Rev. B 78 197101
-
(2008)
Phys. Rev.
, vol.78
, Issue.19
-
-
Zhao, Y.1
Truhlar, D.G.2
-
25
-
-
57149144954
-
-
10.1103/PhysRevB.78.197102 1098-0121 B 197102
-
Wu Z and Cohen R E 2008 Phys. Rev. B 78 197102
-
(2008)
Phys. Rev.
, vol.78
, Issue.19
-
-
Wu, Z.1
Cohen, R.E.2
-
26
-
-
26144450583
-
-
10.1103/PhysRevB.23.5048 0163-1829 B
-
Perdew J P and Zunger A 1981 Phys. Rev. B 23 5048
-
(1981)
Phys. Rev.
, vol.23
, Issue.10
, pp. 5048
-
-
Perdew, J.P.1
Zunger, A.2
-
27
-
-
70349568754
-
-
10.1088/0953-8984/21/39/395502 0953-8984 395502
-
Giannozzi P et al 2009 J. Phys.: Condens. Matter 21 395502 See www.quantum-espresso.org
-
(2009)
J. Phys.: Condens. Matter
, vol.21
, Issue.39
-
-
Giannozzi, P.1
-
28
-
-
25744460922
-
-
10.1103/PhysRevB.50.17953 0163-1829 B
-
Blöchl P E 1994 Phys. Rev. B 50 17953
-
(1994)
Phys. Rev.
, vol.50
, Issue.24
, pp. 17953
-
-
Blöchl, P.E.1
-
29
-
-
0011236321
-
-
10.1103/PhysRevB.59.1758 1098-0121 B
-
Kresse G and Joubert D 1999 Phys. Rev. B 59 1758
-
(1999)
Phys. Rev.
, vol.59
, Issue.3
, pp. 1758
-
-
Kresse, G.1
Joubert, D.2
-
30
-
-
0035894105
-
-
10.1103/PhysRevB.64.235118 0163-1829 B 235118
-
Dal Corso A 2001 Phys. Rev. B 64 235118
-
(2001)
Phys. Rev.
, vol.64
, Issue.23
-
-
Dal Corso, A.1
-
31
-
-
77954858570
-
-
10.1103/PhysRevB.81.075123 1098-0121 B 075123
-
Dal Corso A 2010 Phys. Rev. B 81 075123
-
(2010)
Phys. Rev.
, vol.81
, Issue.7
-
-
Dal Corso, A.1
-
32
-
-
84865639306
-
-
10.1103/PhysRevB.86.085135 1098-0121 B 085135
-
Dal Corso A 2012 Phys. Rev. B 86 085135
-
(2012)
Phys. Rev.
, vol.86
, Issue.8
-
-
Dal Corso, A.1
-
33
-
-
84875189264
-
-
Dal Corso A Unpublished
-
Dal Corso A Unpublished
-
-
-
-
37
-
-
33747224321
-
-
10.1088/0953-8984/18/34/006 0953-8984
-
Sklyadneva I Y, Leonardo A, Echenique P M, Eremeev S V and Chulkov E V 2006 J. Phys.: Condens. Matter 18 7923
-
(2006)
J. Phys.: Condens. Matter
, vol.18
, Issue.34
, pp. 7923
-
-
Sklyadneva, I.Y.1
Leonardo, A.2
Echenique, P.M.3
Eremeev, S.V.4
Chulkov, E.V.5
-
41
-
-
36049057991
-
-
10.1103/PhysRev.164.922 0031-899X
-
Nicklow R M, Gilat G, Smith H G, Raubenheimer L J and Wilkinson M K 1967 Phys. Rev. 164 922
-
(1967)
Phys. Rev.
, vol.164
, Issue.3
, pp. 922
-
-
Nicklow, R.M.1
Gilat, G.2
Smith, H.G.3
Raubenheimer, L.J.4
Wilkinson, M.K.5
-
43
-
-
0012278785
-
-
10.1103/PhysRev.143.422 0031-899X
-
Sinha S K 1966 Phys. Rev. 143 422
-
(1966)
Phys. Rev.
, vol.143
, Issue.2
, pp. 422
-
-
Sinha, S.K.1
-
45
-
-
34250460925
-
-
10.1007/BF01392533 1434-6001
-
Drexel W 1972 Z. Phys. 255 281
-
(1972)
Z. Phys.
, vol.255
, Issue.4
, pp. 281
-
-
Drexel, W.1
-
52
-
-
48749123838
-
-
10.1103/PhysRevB.78.024304 1098-0121 B 024304
-
Sun T, Umemoto K, Wu Z, Zheng J-C and Wentzcovitch R M 2008 Phys. Rev. B 78 024304
-
(2008)
Phys. Rev.
, vol.78
, Issue.2
-
-
Sun, T.1
Umemoto, K.2
Wu, Z.3
Zheng, J.-C.4
Wentzcovitch, R.M.5
-
55
-
-
0000776774
-
-
10.1088/0953-8984/10/36/007 0953-8984
-
Heid R, Bohnen K-P, Felix K, Ho K M and Reichardt W 1998 J. Phys.: Condens. Matter 10 7967
-
(1998)
J. Phys.: Condens. Matter
, vol.10
, Issue.36
, pp. 7967
-
-
Heid, R.1
Bohnen, K.-P.2
Felix, K.3
Ho, K.M.4
Reichardt, W.5
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