-
1
-
-
0035529353
-
-
For a review, see, RMPHAT 0034-6861 10.1103/RevModPhys.73.33
-
For a review, see W. M. C. Foulkes, L. Mitas, R. J. Needs, and G. Rajagopal, Rev. Mod. Phys. RMPHAT 0034-6861 10.1103/RevModPhys.73.33 73, 33 (2001).
-
(2001)
Rev. Mod. Phys.
, vol.73
, pp. 33
-
-
Foulkes, W.M.C.1
Mitas, L.2
Needs, R.J.3
Rajagopal, G.4
-
2
-
-
3342965087
-
-
PRLTAO 0031-9007 10.1103/PhysRevLett.83.2351
-
W.-K. Leung, R. J. Needs, G. Rajagopal, S. Itoh, and S. Ihara, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.83.2351 83, 2351 (1999).
-
(1999)
Phys. Rev. Lett.
, vol.83
, pp. 2351
-
-
Leung, W.-K.1
Needs, R.J.2
Rajagopal, G.3
Itoh, S.4
Ihara, S.5
-
3
-
-
0141571206
-
-
PRLTAO 0031-9007 10.1103/PhysRevLett.91.076403
-
R. Q. Hood, P. R. C. Kent, R. J. Needs, and P. R. Briddon, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.91.076403 91, 076403 (2003).
-
(2003)
Phys. Rev. Lett.
, vol.91
, pp. 076403
-
-
Hood, R.Q.1
Kent, P.R.C.2
Needs, R.J.3
Briddon, P.R.4
-
4
-
-
0031378796
-
-
PRLTAO 0031-9007 10.1103/PhysRevLett.79.4353
-
J. C. Grossman and L. Mitas, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.79.4353 79, 4353 (1997).
-
(1997)
Phys. Rev. Lett.
, vol.79
, pp. 4353
-
-
Grossman, J.C.1
Mitas, L.2
-
5
-
-
0036695278
-
-
PRBMDO 1098-0121 10.1103/PhysRevB.66.052104
-
R. Gaudoin and W. M. C. Foulkes, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.66.052104 66, 052104 (2002).
-
(2002)
Phys. Rev. B
, vol.66
, pp. 052104
-
-
Gaudoin, R.1
Foulkes, W.M.C.2
-
6
-
-
0037200820
-
Ab initio calculations of the cohesive energy and the bulk modulus of aluminium
-
DOI 10.1088/0953-8984/14/38/303, PII S0953898402391112
-
R. Gaudoin, W. M. C. Foulkes, and G. Rajagopal, J. Phys. Condens. Matter JCOMEL 0953-8984 10.1088/0953-8984/14/38/303 14, 8787 (2002). (Pubitemid 35236654)
-
(2002)
Journal of Physics Condensed Matter
, vol.14
, Issue.38
, pp. 8787-8793
-
-
Gaudoin, R.1
Foulkes, W.M.C.2
Rajagopal, G.3
-
7
-
-
0034295223
-
Vacancies in metals: from first-principles calculations to experimental data
-
DOI 10.1103/PhysRevLett.85.3862
-
K. Carling, G. Wahnstrom, T. R. Mattsson, A. E. Mattsson, N. Sandberg, and G. Grimvall, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.85.3862 85, 3862 (2000). (Pubitemid 32027202)
-
(2000)
Physical Review Letters
, vol.85
, Issue.18
, pp. 3862-3865
-
-
Carling, K.1
Wahnstrom, G.2
Mattsson, T.R.3
Mattsson, A.E.4
Sandberg, N.5
Grimvall, G.6
-
8
-
-
33744492305
-
Nonequivalence of the generalized gradient approximations PBE and PW91
-
DOI 10.1103/PhysRevB.73.195123
-
A. E. Mattsson, R. Armiento, P. A. Schultz, and T. R. Mattsson, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.73.195123 73, 195123 (2006). (Pubitemid 43801266)
-
(2006)
Physical Review B - Condensed Matter and Materials Physics
, vol.73
, Issue.19
, pp. 195123
-
-
Mattsson, A.E.1
Armiento, R.2
Schultz, P.A.3
Mattsson, T.R.4
-
9
-
-
77954720407
-
-
PRBMDO 1098-0121 10.1103/PhysRevB.80.205121
-
L. Delczeg, E. K. Delczeg-Czirjak, B. Johansson, and L. Vitos, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.80.205121 80, 205121 (2009).
-
(2009)
Phys. Rev. B
, vol.80
, pp. 205121
-
-
Delczeg, L.1
Delczeg-Czirjak, E.K.2
Johansson, B.3
Vitos, L.4
-
10
-
-
0003869768
-
-
Springer, Heidelberg
-
P. Erhart, P. Jung, H. Schult, and H. Ullmaier, Atomic Defects in Metals, Landolt-Börnstein, New Series, Group III, Condensed Matter, Vol. 25 (Springer, Heidelberg, 1991).
-
(1991)
Atomic Defects in Metals
-
-
Erhart, P.1
Jung, P.2
Schult, H.3
Ullmaier, H.4
-
11
-
-
0028524490
-
-
JPCSAW 0022-3697 10.1016/0022-3697(94)90110-4
-
T. Hehenkamp, J. Phys. Chem. Solids JPCSAW 0022-3697 10.1016/0022- 3697(94)90110-4 55, 907 (1994).
-
(1994)
J. Phys. Chem. Solids
, vol.55
, pp. 907
-
-
Hehenkamp, T.1
-
12
-
-
0001196475
-
-
PRBMDO 1098-0121 10.1103/PhysRevB.17.3444
-
M. J. Fluss, L. C. Smedskjaer, M. K. Chason, D. G. Legnini, and R. W. Siegel, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.17.3444 17, 3444 (1978).
-
(1978)
Phys. Rev. B
, vol.17
, pp. 3444
-
-
Fluss, M.J.1
Smedskjaer, L.C.2
Chason, M.K.3
Legnini, D.G.4
Siegel, R.W.5
-
14
-
-
49749219000
-
-
AMETAR 0001-6160 10.1016/0001-6160(59)90112-9
-
W. DeSorbo and D. Turnbull, Acta Met. AMETAR 0001-6160 10.1016/0001-6160(59)90112-9 7, 83 (1959);
-
(1959)
Acta Met.
, vol.7
, pp. 83
-
-
Desorbo, W.1
Turnbull, D.2
-
15
-
-
3943094370
-
-
PHRVAO 0031-899X 10.1103/PhysRev.115.560
-
W. DeSorbo and D. Turnbull, Phys. Rev. PHRVAO 0031-899X 10.1103/PhysRev.115.560 115, 560 (1959).
-
(1959)
Phys. Rev.
, vol.115
, pp. 560
-
-
Desorbo, W.1
Turnbull, D.2
-
16
-
-
0347064230
-
-
PRBMDO 1098-0121 10.1103/PhysRevB.68.184103
-
T. Uesugi, M. Kohyama, and K. Higashi, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.68.184103 68, 184103 (2003).
-
(2003)
Phys. Rev. B
, vol.68
, pp. 184103
-
-
Uesugi, T.1
Kohyama, M.2
Higashi, K.3
-
17
-
-
0001247692
-
-
JPFMAT 0305-4608 10.1088/0305-4608/14/12/008
-
M. J. Fluss, S. Berko, B. Chakraborty, K. R. Hoffmann, P. Lippel, and R. W. Siegel, J. Phys. F JPFMAT 0305-4608 10.1088/0305-4608/14/12/008 14, 2831 (1984).
-
(1984)
J. Phys. F
, vol.14
, pp. 2831
-
-
Fluss, M.J.1
Berko, S.2
Chakraborty, B.3
Hoffmann, K.R.4
Lippel, P.5
Siegel, R.W.6
-
18
-
-
36149019052
-
-
PHRVAO 0031-899X 10.1103/PhysRev.113.781
-
A. C. Damask, G. J. Dienes, and V. G. Weizer, Phys. Rev. PHRVAO 0031-899X 10.1103/PhysRev.113.781 113, 781 (1959).
-
(1959)
Phys. Rev.
, vol.113
, pp. 781
-
-
Damask, A.C.1
Dienes, G.J.2
Weizer, V.G.3
-
19
-
-
0000818597
-
-
PRBMDO 1098-0121 10.1103/PhysRevB.38.1087
-
H. Rajainmäki, S. Linderoth, H. E. Hansen, R. M. Nieminen, and M. D. Bentzon, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.38.1087 38, 1087 (1988).
-
(1988)
Phys. Rev. B
, vol.38
, pp. 1087
-
-
Rajainmäki, H.1
Linderoth, S.2
Hansen, H.E.3
Nieminen, R.M.4
Bentzon, M.D.5
-
21
-
-
3342984122
-
-
JNUMAM 0022-3115 10.1016/j.jnucmat.2004.04.291
-
D. Hamaguchi and Y. Dai, J. Nucl. Mater. JNUMAM 0022-3115 10.1016/j.jnucmat.2004.04.291 329, 958 (2004).
-
(2004)
J. Nucl. Mater.
, vol.329
, pp. 958
-
-
Hamaguchi, D.1
Dai, Y.2
-
22
-
-
0345359338
-
-
JNUMAM 0022-3115 10.1016/j.jnucmat.2003.08.007
-
Y. Katoh, M. Ando, and A. Kohyama, J. Nucl. Mater. JNUMAM 0022-3115 10.1016/j.jnucmat.2003.08.007 323, 251 (2003).
-
(2003)
J. Nucl. Mater.
, vol.323
, pp. 251
-
-
Katoh, Y.1
Ando, M.2
Kohyama, A.3
-
23
-
-
0004635261
-
-
PRBMDO 1098-0121 10.1103/PhysRevB.44.4206
-
R. Vassen, H. Trinkaus, and P. Jung, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.44.4206 44, 4206 (1991).
-
(1991)
Phys. Rev. B
, vol.44
, pp. 4206
-
-
Vassen, R.1
Trinkaus, H.2
Jung, P.3
-
24
-
-
60049087589
-
-
PHYBE3 0921-4526 10.1016/j.physb.2008.02.015
-
L. Yang, X. T. Zu, and F. Gao, Phys. B PHYBE3 0921-4526 10.1016/j.physb.2008.02.015 403, 2719 (2008).
-
(2008)
Phys. B
, vol.403
, pp. 2719
-
-
Yang, L.1
Zu, X.T.2
Gao, F.3
-
25
-
-
33947227272
-
Alleviation of the fermion-sign problem by optimization of many-body wave functions
-
DOI 10.1103/PhysRevLett.98.110201
-
C. J. Umrigar, J. Toulouse, C. Filippi, S. Sorella, and R. G. Hennig, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.98.110201 98, 110201 (2007). (Pubitemid 46434400)
-
(2007)
Physical Review Letters
, vol.98
, Issue.11
, pp. 110201
-
-
Umrigar, C.J.1
Toulouse, J.2
Filippi, C.3
Sorella, S.4
Hennig, R.G.5
-
26
-
-
77952337037
-
-
PRLTAO 0031-9007 10.1103/PhysRevLett.104.193001
-
M. Bajdich, M. L. Tiago, R. Q. Hood, P. R. C. Kent, and F. A. Reboredo, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.104.193001 104, 193001 (2010).
-
(2010)
Phys. Rev. Lett.
, vol.104
, pp. 193001
-
-
Bajdich, M.1
Tiago, M.L.2
Hood, R.Q.3
Kent, P.R.C.4
Reboredo, F.A.5
-
27
-
-
77951926943
-
-
PRLTAO 0031-9007 10.1103/PhysRevLett.104.185702
-
K. P. Esler, R. E. Cohen, B. Militzer, J. Kim, R. J. Needs, and M. D. Towler, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.104.185702 104, 185702 (2010).
-
(2010)
Phys. Rev. Lett.
, vol.104
, pp. 185702
-
-
Esler, K.P.1
Cohen, R.E.2
Militzer, B.3
Kim, J.4
Needs, R.J.5
Towler, M.D.6
-
28
-
-
72249083940
-
-
JCOMEL 0953-8984 10.1088/0953-8984/22/2/023201
-
R. J. Needs, M. D. Towler, N. D. Drummond, and P. López Ríos, J. Phys. Condens. Matter JCOMEL 0953-8984 10.1088/0953-8984/22/2/ 023201 22, 023201 (2010).
-
(2010)
J. Phys. Condens. Matter
, vol.22
, pp. 023201
-
-
Needs, R.J.1
Towler, M.D.2
Drummond, N.D.3
López Ríos, P.4
-
29
-
-
33846361964
-
-
PNASA6 0027-8424 10.1073/pnas.30.9.244
-
F. D. Murnaghan, Proc. Natl. Acad. Sci. USA PNASA6 0027-8424 10.1073/pnas.30.9.244 30, 244 (1944).
-
(1944)
Proc. Natl. Acad. Sci. USA
, vol.30
, pp. 244
-
-
Murnaghan, F.D.1
-
31
-
-
23244460838
-
-
PRBMDO 1098-0121 10.1103/PhysRevB.46.6671
-
J. P. Perdew, J. A. Chevary, S. H. Vosko, K. A. Jackson, M. R. Pederson, D. J. Singh, and C. Fiolhais, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.46. 6671 46, 6671 (1992);
-
(1992)
Phys. Rev. B
, vol.46
, pp. 6671
-
-
Perdew, J.P.1
Chevary, J.A.2
Vosko, S.H.3
Jackson, K.A.4
Pederson, M.R.5
Singh, D.J.6
Fiolhais, C.7
-
32
-
-
0001622167
-
-
PRBMDO 1098-0121 10.1103/PhysRevB.48.4978.2
-
J. P. Perdew, J. A. Chevary, S. H. Vosko, K. A. Jackson, M. R. Pederson, D. J. Singh, and C. Fiolhais, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.48. 4978.2 48, 4978 (1993).
-
(1993)
Phys. Rev. B
, vol.48
, pp. 4978
-
-
Perdew, J.P.1
Chevary, J.A.2
Vosko, S.H.3
Jackson, K.A.4
Pederson, M.R.5
Singh, D.J.6
Fiolhais, C.7
-
33
-
-
70349568754
-
-
JCOMEL 0953-8984 10.1088/0953-8984/21/39/395502
-
P. Giannozzi, J. Phys. Condens. Matter JCOMEL 0953-8984 10.1088/0953-8984/21/39/395502 21, 395502 (2009).
-
(2009)
J. Phys. Condens. Matter
, vol.21
, pp. 395502
-
-
Giannozzi, P.1
-
36
-
-
0035393049
-
-
PLEEE8 1539-3755 10.1103/PhysRevE.64.016702
-
C. Lin, F. H. Zong, and D. M. Ceperley, Phys. Rev. E PLEEE8 1539-3755 10.1103/PhysRevE.64.016702 64, 016702 (2001).
-
(2001)
Phys. Rev. e
, vol.64
, pp. 016702
-
-
Lin, C.1
Zong, F.H.2
Ceperley, D.M.3
-
38
-
-
52249087141
-
-
PRBMDO 1098-0121 10.1103/PhysRevB.78.125106
-
N. D. Drummond, R. J. Needs, A. Sorouri, and W. M. C. Foulkes, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.78.125106 78, 125106 (2008).
-
(2008)
Phys. Rev. B
, vol.78
, pp. 125106
-
-
Drummond, N.D.1
Needs, R.J.2
Sorouri, A.3
Foulkes, W.M.C.4
-
39
-
-
33845674060
-
Inhomogeneous backflow transformations in quantum Monte Carlo calculations
-
DOI 10.1103/PhysRevE.74.066701
-
P. López Ríos, A. Ma, N. D. Drummond, M. D. Towler, and R. J. Needs, Phys. Rev. E PLEEE8 1539-3755 10.1103/PhysRevE.74.066701 74, 066701 (2006). (Pubitemid 44958110)
-
(2006)
Physical Review E - Statistical, Nonlinear, and Soft Matter Physics
, vol.74
, Issue.6
, pp. 066701
-
-
Lopez Rios, P.1
Ma, A.2
Drummond, N.D.3
Towler, M.D.4
Needs, R.J.5
-
40
-
-
46749128171
-
-
PRBMDO 1098-0121 10.1103/PhysRevB.78.024101
-
A. A. Correa, L. X. Benedict, D. A. Young, E. Schwegler, and S. A. Bonev, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.78.024101 78, 024101 (2008).
-
(2008)
Phys. Rev. B
, vol.78
, pp. 024101
-
-
Correa, A.A.1
Benedict, L.X.2
Young, D.A.3
Schwegler, E.4
Bonev, S.A.5
-
42
-
-
44649096556
-
First-principles calculation of self-diffusion coefficients
-
DOI 10.1103/PhysRevLett.100.215901
-
M. Mantina, Y. Wang, R. Arroyave, L. Q. Chen, Z. K. Liu, and C. Wolverton, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.100.215901 100, 215901 (2008). (Pubitemid 351777203)
-
(2008)
Physical Review Letters
, vol.100
, Issue.21
, pp. 215901
-
-
Mantina, M.1
Wang, Y.2
Arroyave, R.3
Chen, L.Q.4
Liu, Z.K.5
Wolverton, C.6
-
43
-
-
0000585365
-
-
PHRVAO 0031-899X 10.1103/PhysRev.134.A522
-
M. Doyama and J. S. Koehler, Phys. Rev. PHRVAO 0031-899X 10.1103/PhysRev.134.A522 134, A522 (1964).
-
(1964)
Phys. Rev.
, vol.134
, pp. 522
-
-
Doyama, M.1
Koehler, J.S.2
-
44
-
-
0017933236
-
-
JNUMAM 0022-3115 10.1016/0022-3115(78)90261-1
-
W. Schilling, J. Nucl. Mater. JNUMAM 0022-3115 10.1016/0022-3115(78) 90261-1 69, 465 (1978).
-
(1978)
J. Nucl. Mater.
, vol.69
, pp. 465
-
-
Schilling, W.1
|