-
2
-
-
0032986742
-
-
AMMIAY 0003-004X
-
S. A. T. Redfern, R. J. Harrison, H. S. C. O'Neill, and D. R. R. Wood, Am. Mineral. AMMIAY 0003-004X 84, 299 (1999).
-
(1999)
Am. Mineral.
, vol.84
, pp. 299
-
-
Redfern, S.A.T.1
Harrison, R.J.2
O'Neill, H.S.C.3
Wood, D.R.R.4
-
3
-
-
0033792212
-
-
AMMIAY 0003-004X
-
G. B. Andreozzi, F. Princivalle, H. Skogby, and A. D. Giusta, Am. Mineral. AMMIAY 0003-004X 85, 1164 (2000).
-
(2000)
Am. Mineral.
, vol.85
, pp. 1164
-
-
Andreozzi, G.B.1
Princivalle, F.2
Skogby, H.3
Giusta, A.D.4
-
7
-
-
0031414086
-
-
AMMIAY 0003-004X
-
H. Maekawa, S. Kato, K. Kawamura, and T. Yokokawa, Am. Mineral. AMMIAY 0003-004X 82, 1125 (1997).
-
(1997)
Am. Mineral.
, vol.82
, pp. 1125
-
-
Maekawa, H.1
Kato, S.2
Kawamura, K.3
Yokokawa, T.4
-
8
-
-
0001677185
-
-
PYLAAG 0375-9601 10.1016/0375-9601(72)90672-X
-
U. Schmocker, H. R. Boesh, and F. Waldner, Phys. Lett. A PYLAAG 0375-9601 10.1016/0375-9601(72)90672-X 40, 237 (1972).
-
(1972)
Phys. Lett. A
, vol.40
, pp. 237
-
-
Schmocker, U.1
Boesh, H.R.2
Waldner, F.3
-
11
-
-
4243977977
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.63.045112
-
S. H. Wei and S. B. Zhang, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.63.045112 63, 045112 (2001).
-
(2001)
Phys. Rev. B
, vol.63
, pp. 045112
-
-
Wei, S.H.1
Zhang, S.B.2
-
12
-
-
0000214080
-
-
PRLTAO 0031-9007 10.1103/PhysRevLett.65.353
-
A. Zunger, S. H. Wei, L. G. Ferreira, and J. E. Bernard, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.65.353 65, 353 (1990).
-
(1990)
Phys. Rev. Lett.
, vol.65
, pp. 353
-
-
Zunger, A.1
Wei, S.H.2
Ferreira, L.G.3
Bernard, J.E.4
-
17
-
-
48549112275
-
-
PHYADX 0378-4371 10.1016/0378-4371(84)90096-7
-
J. M. Sanchez, F. Ducastelle, and D. Gratias, Physica A PHYADX 0378-4371 10.1016/0378-4371(84)90096-7 128, 334 (1984).
-
(1984)
Physica A
, vol.128
, pp. 334
-
-
Sanchez, J.M.1
Ducastelle, F.2
Gratias, D.3
-
20
-
-
0000532017
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.58.2975
-
A. Van der Ven, M. K. Aydinol, G. Ceder, G. Kresse, and J. Hafner, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.58.2975 58, 2975 (1998).
-
(1998)
Phys. Rev. B
, vol.58
, pp. 2975
-
-
Van Der Ven, A.1
Aydinol, M.K.2
Ceder, G.3
Kresse, G.4
Hafner, J.5
-
21
-
-
0040308865
-
-
JOELFJ 1385-3449 10.1023/A:1009942213941
-
G. Ceder, P. Tepesch, A. Kohan, and A. Van der Ven, J. Electroceram. JOELFJ 1385-3449 10.1023/A:1009942213941 1, 15 (1997).
-
(1997)
J. Electroceram.
, vol.1
, pp. 15
-
-
Ceder, G.1
Tepesch, P.2
Kohan, A.3
Van Der Ven, A.4
-
22
-
-
33749158997
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.72.024107
-
A. Seko, F. Oba, A. Kuwabara, and I. Tanaka, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.72.024107 72, 024107 (2005).
-
(2005)
Phys. Rev. B
, vol.72
, pp. 024107
-
-
Seko, A.1
Oba, F.2
Kuwabara, A.3
Tanaka, I.4
-
24
-
-
0036672595
-
-
JPEQE6 1054-9714 10.1361/105497102770331596
-
A. Van de Walle and G. Ceder, J. Phase Equilib. JPEQE6 1054-9714 10.1361/105497102770331596 23, 348 (2002).
-
(2002)
J. Phase Equilib.
, vol.23
, pp. 348
-
-
Van De Walle, A.1
Ceder, G.2
-
25
-
-
17644426018
-
-
NMAACR 1476-1122 10.1038/nmat1374
-
G. L. W. Hart, V. Blum, M. J. Walorski, and A. Zunger, Nat. Mater. NMAACR 1476-1122 10.1038/nmat1374 4, 391 (2005).
-
(2005)
Nat. Mater.
, vol.4
, pp. 391
-
-
Hart, G.L.W.1
Blum, V.2
Walorski, M.J.3
Zunger, A.4
-
26
-
-
17644370009
-
-
NMAACR 1476-1122 10.1038/nmat1378
-
A. Van de Walle, Nat. Mater. NMAACR 1476-1122 10.1038/nmat1378 4, 362 (2005).
-
(2005)
Nat. Mater.
, vol.4
, pp. 362
-
-
Van De Walle, A.1
-
27
-
-
12844286241
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.47.558
-
G. Kresse and J. Hafner, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.47.558 47, R558 (1993).
-
(1993)
Phys. Rev. B
, vol.47
, pp. 558
-
-
Kresse, G.1
Hafner, J.2
-
28
-
-
2442537377
-
-
PRBMDO. 0163-1829. 10.1103/PhysRevB.54.11169
-
G. Kresse and J. Furthmüller, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.54.11169 54, 11169 (1996).
-
(1996)
Phys. Rev. B
, vol.54
, pp. 11169
-
-
Kresse, G.1
Furthmüller, J.2
-
29
-
-
0030190741
-
-
CMMSEM. 0927-0256. 10.1016/0927-0256(96)00008-0
-
G. Kresse and J. Furthmüller, Comput. Mater. Sci. CMMSEM 0927-0256 10.1016/0927-0256(96)00008-0 6, 15 (1996).
-
(1996)
Comput. Mater. Sci.
, vol.6
, pp. 15
-
-
Kresse, G.1
Furthmüller, J.2
-
30
-
-
25744460922
-
-
PRBMDO. 0163-1829. 10.1103/PhysRevB.50.17953
-
P. E. Blöchl, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.50. 17953 50, 17953 (1994).
-
(1994)
Phys. Rev. B
, vol.50
, pp. 17953
-
-
Blöchl, P.E.1
-
31
-
-
0011236321
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.59.1758
-
G. Kresse and D. Joubert, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.59.1758 59, 1758 (1999).
-
(1999)
Phys. Rev. B
, vol.59
, pp. 1758
-
-
Kresse, G.1
Joubert, D.2
-
32
-
-
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
-
33
-
-
26144450583
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.23.5048
-
J. P. Perdew and A. Zunger, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.23.5048 23, 5048 (1981).
-
(1981)
Phys. Rev. B
, vol.23
, pp. 5048
-
-
Perdew, J.P.1
Zunger, A.2
-
34
-
-
1842816907
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.13.5188
-
H. J. Monkhorst and J. D. Pack, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.13.5188 13, 5188 (1976).
-
(1976)
Phys. Rev. B
, vol.13
, pp. 5188
-
-
Monkhorst, H.J.1
Pack, J.D.2
-
36
-
-
5744249209
-
-
JCPSA6 0021-9606 10.1063/1.1699114
-
N. Metropolis, A. W. Rosenbluth, M. N. Rosenbluth, A. H. Teller, and E. Teller, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1699114 21, 1087 (1953).
-
(1953)
J. Chem. Phys.
, vol.21
, pp. 1087
-
-
Metropolis, N.1
Rosenbluth, A.W.2
Rosenbluth, M.N.3
Teller, A.H.4
Teller, E.5
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