-
1
-
-
37549004997
-
-
10.1016/0009-2614(94)01027-7
-
P. Pulay and S. Kristyan, Chem. Phys. Lett. 229, 175 (1994). 10.1016/0009-2614(94)01027-7
-
(1994)
Chem. Phys. Lett.
, vol.229
, pp. 175
-
-
Pulay, P.1
Kristyan, S.2
-
5
-
-
3242718844
-
-
10.1103/PhysRevLett.92.246401
-
M. Dion, H. Rydberg, E. Schröder, D. C. Langreth, and B. I. Lundqvist, Phys. Rev. Lett. 92, 246401 (2004). 10.1103/PhysRevLett.92.246401
-
(2004)
Phys. Rev. Lett.
, vol.92
, pp. 246401
-
-
Dion, M.1
Rydberg, H.2
Schröder, E.3
Langreth, D.C.4
Lundqvist, B.I.5
-
6
-
-
34648834821
-
-
10.1103/PhysRevB.76.125112
-
T. Thonhauser, V. R. Cooper, S. Li, A. Puzder, P. Hyldgaard, and D. C. Langreth, Phys. Rev. B 76, 125112 (2007). 10.1103/PhysRevB.76.125112
-
(2007)
Phys. Rev. B
, vol.76
, pp. 125112
-
-
Thonhauser, T.1
Cooper, V.R.2
Li, S.3
Puzder, A.4
Hyldgaard, P.5
Langreth, D.C.6
-
7
-
-
72449139073
-
-
10.1063/1.3269802
-
T. Sato and H. Nakai, J. Chem. Phys. 131, 224104 (2009). 10.1063/1.3269802
-
(2009)
J. Chem. Phys.
, vol.131
, pp. 224104
-
-
Sato, T.1
Nakai, H.2
-
8
-
-
28344439628
-
A density-functional model of the dispersion interaction
-
DOI 10.1063/1.2065267, 154101
-
A. D. Becke and E. R. Johnson, J. Chem. Phys. 123, 154101 (2005). 10.1063/1.2065267 (Pubitemid 41716911)
-
(2005)
Journal of Chemical Physics
, vol.123
, Issue.15
, pp. 1-9
-
-
Becke, A.D.1
Johnson, E.R.2
-
10
-
-
39349094045
-
Exchange-hole dipole moment and the dispersion interaction revisited
-
DOI 10.1063/1.2795701
-
A. D. Becke and E. R. Johnson, J. Chem. Phys. 127, 154108 (2007). 10.1063/1.2795701 (Pubitemid 351260743)
-
(2007)
Journal of Chemical Physics
, vol.127
, Issue.15
, pp. 154108
-
-
Becke, A.D.1
Johnson, E.R.2
-
11
-
-
18144378706
-
-
10.1103/PhysRevB.33.8800
-
J. P. Perdew and Y. Wang, Phys. Rev. B 33, 8800 (1986). 10.1103/PhysRevB.33.8800
-
(1986)
Phys. Rev. B
, vol.33
, pp. 8800
-
-
Perdew, J.P.1
Wang, Y.2
-
15
-
-
69149091172
-
-
10.1063/1.3173809
-
L. F. Molnar, X. He, B. Wang, and K. M. Merz, J. Chem. Phys. 131, 065102 (2009). 10.1063/1.3173809
-
(2009)
J. Chem. Phys.
, vol.131
, pp. 065102
-
-
Molnar, L.F.1
He, X.2
Wang, B.3
Merz, K.M.4
-
16
-
-
77955578570
-
-
10.1021/ct1002253
-
L. Grafova, M. Pitonak, J. Rezac, and P. Hobza, J. Chem. Theory Comput. 6, 2365 (2010). 10.1021/ct1002253
-
(2010)
J. Chem. Theory Comput.
, vol.6
, pp. 2365
-
-
Grafova, L.1
Pitonak, M.2
Rezac, J.3
Hobza, P.4
-
18
-
-
80455149663
-
-
10.1103/PhysRevB.84.155407
-
J. Sarabadani, A. Naji, R. Asgari, and R. Podgornik, Phys. Rev. B 84, 155407 (2011). 10.1103/PhysRevB.84.155407
-
(2011)
Phys. Rev. B
, vol.84
, pp. 155407
-
-
Sarabadani, J.1
Naji, A.2
Asgari, R.3
Podgornik, R.4
-
19
-
-
33744470857
-
-
10.1039/b600027d
-
P. Jurecka, J. Sponer, J. Cerny, and P. Hobza, Phys. Chem. Chem. Phys. 8, 1985 (2006). 10.1039/b600027d
-
(2006)
Phys. Chem. Chem. Phys.
, vol.8
, pp. 1985
-
-
Jurecka, P.1
Sponer, J.2
Cerny, J.3
Hobza, P.4
-
20
-
-
70450206724
-
-
Revision A.02, Gaussian, Inc., Wallingford CT
-
M. J. Frisch, G. W. Trucks, H. B. Schlegel, GAUSSIAN 09, Revision A.02, Gaussian, Inc., Wallingford CT, 2009.
-
(2009)
Gaussian 09
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
-
21
-
-
66049159363
-
-
10.1103/PhysRevA.79.042510
-
J. Kong, Z. Gan, E. Proynov, M. Freindorf, and T. R. Furlani, Phys. Rev. A 79, 042510 (2009). 10.1103/PhysRevA.79.042510
-
(2009)
Phys. Rev. A
, vol.79
, pp. 042510
-
-
Kong, J.1
Gan, Z.2
Proynov, E.3
Freindorf, M.4
Furlani, T.R.5
-
22
-
-
84855566187
-
-
10.1063/1.3672236
-
A. Hesselmann, J. Chem. Phys. 136, 014104 (2012). 10.1063/1.3672236
-
(2012)
J. Chem. Phys.
, vol.136
, pp. 014104
-
-
Hesselmann, A.1
-
23
-
-
23444462078
-
A post-Hartree-Fock model of intermolecular interactions
-
DOI 10.1063/1.1949201, 024101
-
E. R. Johnson and A. D. Becke, J. Chem. Phys. 123, 024101 (2005). 10.1063/1.1949201 (Pubitemid 41107698)
-
(2005)
Journal of Chemical Physics
, vol.123
, Issue.2
, pp. 1-7
-
-
Johnson, E.R.1
Becke, A.D.2
-
25
-
-
0038617502
-
-
10.1063/1.1569242
-
S. Grimme, J. Chem. Phys. 118, 9095 (2003). 10.1063/1.1569242
-
(2003)
J. Chem. Phys.
, vol.118
, pp. 9095
-
-
Grimme, S.1
-
26
-
-
4243553426
-
-
10.1103/PhysRevA.38.3098
-
A. D. Becke, Phys. Rev. A 38, 3098 (1988). 10.1103/PhysRevA.38.3098
-
(1988)
Phys. Rev. A
, vol.38
, pp. 3098
-
-
Becke, A.D.1
|