-
1
-
-
10644250257
-
-
PRVAAH 0096-8250 10.1103/PhysRev.136.B864
-
P. Hohenberg and W. Kohn, Phys. Rev. PRVAAH 0096-8250 10.1103/PhysRev.136.B864 136, B864 (1964).
-
(1964)
Phys. Rev.
, vol.136
, pp. 864
-
-
Hohenberg, P.1
Kohn, W.2
-
2
-
-
0042113153
-
-
PRVBAK 0096-8269 10.1103/PhysRev.140.A1133
-
W. Kohn and L. J. Sham, Phys. Rev. PRVBAK 0096-8269 10.1103/PhysRev.140. A1133 140, A1133 (1965).
-
(1965)
Phys. Rev.
, vol.140
, pp. 1133
-
-
Kohn, W.1
Sham, L.J.2
-
3
-
-
33645898818
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.45.13244
-
J. P. Perdew and Y. Wang, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.45.13244 45, 13244 (1992).
-
(1992)
Phys. Rev. B
, vol.45
, pp. 13244
-
-
Perdew, J.P.1
Wang, Y.2
-
4
-
-
18144378706
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.33.8800
-
J. P. Perdew and Y. Wang, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.33.8800 33, 8800 (1986).
-
(1986)
Phys. Rev. B
, vol.33
, pp. 8800
-
-
Perdew, J.P.1
Wang, Y.2
-
5
-
-
2842565972
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.54.16533
-
J. P. Perdew, K. Burke, and Y. Wang, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.54.16533 54, 16533 (1996).
-
(1996)
Phys. Rev. B
, vol.54
, pp. 16533
-
-
Perdew, J.P.1
Burke, K.2
Wang, Y.3
-
7
-
-
0017547842
-
-
SSCOA4 0038-1098 10.1016/0038-1098(77)90591-9
-
J. Alonso and L. Girifalco, Solid State Commun. SSCOA4 0038-1098 10.1016/0038-1098(77)90591-9 24, 135 (1977).
-
(1977)
Solid State Commun.
, vol.24
, pp. 135
-
-
Alonso, J.1
Girifalco, L.2
-
10
-
-
0037092779
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.65.193106
-
P. P. Rushton, D. J. Tozer, and S. J. Clark, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.65.193106 65, 193106 (2002).
-
(2002)
Phys. Rev. B
, vol.65
, pp. 193106
-
-
Rushton, P.P.1
Tozer, D.J.2
Clark, S.J.3
-
11
-
-
84957124445
-
-
PHSTBO 0031-8949 10.1088/0031-8949/21/3-4/027
-
O. Gunnarsson and R. Jones, Phys. Scr. PHSTBO 0031-8949 10.1088/0031-8949/21/3-4/027 21, 394 (1980).
-
(1980)
Phys. Scr.
, vol.21
, pp. 394
-
-
Gunnarsson, O.1
Jones, R.2
-
12
-
-
0012102468
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.65.235203
-
P. P. Rushton, D. J. Tozer, and S. J. Clark, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.65.235203 65, 235203 (2002).
-
(2002)
Phys. Rev. B
, vol.65
, pp. 235203
-
-
Rushton, P.P.1
Tozer, D.J.2
Clark, S.J.3
-
13
-
-
0037171005
-
-
JCOMEL 0953-8984 10.1088/0953-8984/14/11/301
-
M. D. Segall, P. J. D. Lindan, M. J. Probert, C. J. Pickard, P. J. Hasnip, S. J. Clark, and M. C. Payne, J. Phys.: Condens. Matter JCOMEL 0953-8984 10.1088/0953-8984/14/11/301 14, 2717 (2002).
-
(2002)
J. Phys.: Condens. Matter
, vol.14
, pp. 2717
-
-
Segall, M.D.1
Lindan, P.J.D.2
Probert, M.J.3
Pickard, C.J.4
Hasnip, P.J.5
Clark, S.J.6
Payne, M.C.7
-
14
-
-
20144380685
-
-
ZEKRDZ 0044-2968 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).
-
(2005)
Z. Kristallogr.
, vol.220
, pp. 567
-
-
Clark, S.J.1
Segall, M.D.2
Pickard, C.J.3
Hasnip, P.J.4
Probert, M.J.5
Refson, K.6
Payne, M.C.7
-
15
-
-
33744691386
-
-
PRLTAO 0031-9007 10.1103/PhysRevLett.45.566
-
D. M. Ceperley and B. J. Alder, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.45.566 45, 566 (1980).
-
(1980)
Phys. Rev. Lett.
, vol.45
, pp. 566
-
-
Ceperley, D.M.1
Alder, B.J.2
-
16
-
-
0001679648
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.54.17199
-
P. H. Acioli and D. M. Ceperley, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.54.17199 54, 17199 (1996).
-
(1996)
Phys. Rev. B
, vol.54
, pp. 17199
-
-
Acioli, P.H.1
Ceperley, D.M.2
-
17
-
-
0034670917
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.62.16063
-
P. García-González, J. E. Alvarellos, E. Chacón, and P. Tarazona, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.62.16063 62, 16063 (2000).
-
(2000)
Phys. Rev. B
, vol.62
, pp. 16063
-
-
García-González, P.1
Alvarellos, J.E.2
Chacón, E.3
Tarazona, P.4
-
18
-
-
25544474582
-
-
PLRBAQ 0556-2805 10.1103/PhysRevB.13.4274
-
O. Gunnarsson and B. Lundqvist, Phys. Rev. B PLRBAQ 0556-2805 10.1103/PhysRevB.13.4274 13, 4274 (1976).
-
(1976)
Phys. Rev. B
, vol.13
, pp. 4274
-
-
Gunnarsson, O.1
Lundqvist, B.2
-
19
-
-
0000834901
-
-
CHPLBC 0009-2614 10.1016/0009-2614(93)85156-I
-
J. White and D. Bird, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/0009-2614(93)85156-I 213, 422 (1993).
-
(1993)
Chem. Phys. Lett.
, vol.213
, pp. 422
-
-
White, J.1
Bird, D.2
-
20
-
-
0000680006
-
-
SUSCAS 0039-6028 10.1016/0039-6028(77)90442-3
-
W. Tyson and W. Miller, Surf. Sci. SUSCAS 0039-6028 10.1016/0039-6028(77) 90442-3 62, 267 (1977).
-
(1977)
Surf. Sci.
, vol.62
, pp. 267
-
-
Tyson, W.1
Miller, W.2
-
21
-
-
3342969904
-
-
PRLTAO 0031-9007 10.1103/PhysRevLett.73.1400
-
B. Hammer, M. Scheffler, K. W. Jacobsen, and J. K. Norskov, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.73.1400 73, 1400 (1994).
-
(1994)
Phys. Rev. Lett.
, vol.73
, pp. 1400
-
-
Hammer, B.1
Scheffler, M.2
Jacobsen, K.W.3
Norskov, J.K.4
-
22
-
-
3342950640
-
-
PRLTAO 0031-9007 10.1103/PhysRevLett.73.1404
-
J. A. White, D. M. Bird, M. C. Payne, and I. Stich, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.73.1404 73, 1404 (1994).
-
(1994)
Phys. Rev. Lett.
, vol.73
, pp. 1404
-
-
White, J.A.1
Bird, D.M.2
Payne, M.C.3
Stich, I.4
-
23
-
-
0000573357
-
-
JCOMEL 0953-8984 10.1088/0953-8984/7/36/009
-
A. Forni, G. Wiesenekker, E. Baerends, and G. Tantardini, J. Phys.: Condens. Matter JCOMEL 0953-8984 10.1088/0953-8984/7/36/009 7, 7195 (1995).
-
(1995)
J. Phys.: Condens. Matter
, vol.7
, pp. 7195
-
-
Forni, A.1
Wiesenekker, G.2
Baerends, E.3
Tantardini, G.4
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