-
3
-
-
1542378734
-
-
E. I. Solomon, R. K. Szilagyi, S. B. George, L. Basumallick Chem. Rev., 2004, 104, 419.
-
(2004)
Chem. Rev.
, vol.104
, pp. 419
-
-
Solomon, E.I.1
Szilagyi, R.K.2
George, S.B.3
Basumallick, L.4
-
5
-
-
84964978479
-
-
N. N. Greenwood and A. Earnshaw, Butterworth-Heinemann, Oxford, 2nd edn
-
Chemistry of the Elements, ed. N. N. Greenwood and A. Earnshaw, Butterworth-Heinemann, Oxford, 2nd edn, 1997
-
(1997)
Chemistry of the Elements
-
-
-
6
-
-
0035793354
-
-
A. Pasquarello, I. Petri, P. S. Salmon, O. Parisel, R. Car, E. Toth, D. H. Powell, H. E. Fischer, L. Helm, A. Merbach Science, 2001, 291, 856.
-
(2001)
Science
, vol.291
, pp. 856
-
-
Pasquarello, A.1
Petri, I.2
Salmon, P.S.3
Parisel, O.4
Car, R.5
Toth, E.6
Powell, D.H.7
Fischer, H.E.8
Helm, L.9
Merbach, A.10
-
10
-
-
53849126514
-
-
V. S. Bryantsev, M. S. Diallo, A. C. T. van Duin, W. A. Goddard J. Phys. Chem. A, 2008, 112, 9104.
-
(2008)
J. Phys. Chem. A
, vol.112
, pp. 9104
-
-
Bryantsev, V.S.1
Diallo, M.S.2
Van Duin, A.C.T.3
Goddard, W.A.4
-
11
-
-
0036010403
-
-
I. Persson, P. Persson, M. Sandstrom, A.-S. Ullstrom J. Chem. Soc., Dalton. Trans., 2002, 1256
-
(2002)
J. Chem. Soc., Dalton. Trans.
, vol.1256
-
-
Persson, I.1
Persson, P.2
Sandstrom, M.3
Ullstrom, A.-S.4
-
12
-
-
0010620023
-
-
M. Benfatto, P. DAngelo, S. D. Longa, N. V. Pavel Phys. Rev. B: Condens. Matter Mater. Phys., 2002, 65, 174205.
-
(2002)
Phys. Rev. B: Condens. Matter Mater. Phys.
, vol.65
, pp. 174205
-
-
Benfatto, M.1
Dangelo, P.2
Longa, S.D.3
Pavel, N.V.4
-
13
-
-
15944396580
-
-
P. Frank, M. Benfatto, R. K. Szilagyi, P. D’Angelo, S. D. Longa, K. O. Hodgson Inorg. Chem., 2005, 44, 1922.
-
(2005)
Inorg. Chem.
, vol.44
, pp. 1922
-
-
Frank, P.1
Benfatto, M.2
Szilagyi, R.K.3
D’Angelo, P.4
Longa, S.D.5
Hodgson, K.O.6
-
14
-
-
32644457630
-
-
J. Chaboy, A. Munoz-Paez, P. J. Merkling, E. S. Marcos J. Chem. Phys., 2006, 124, 064509.
-
(2006)
J. Chem. Phys.
, vol.124
, pp. 64509
-
-
Chaboy, J.1
Munoz-Paez, A.2
Merkling, P.J.3
Marcos, E.S.4
-
16
-
-
25844510385
-
-
G. A. Rickard, R. Gomez-Balderas, P. Brunelle, D. F. Raffa, A. Rauk J. Phys. Chem. A, 2005, 109, 8361.
-
(2005)
J. Phys. Chem. A
, vol.109
, pp. 8361
-
-
Rickard, G.A.1
Gomez-Balderas, R.2
Brunelle, P.3
Raffa, D.F.4
Rauk, A.5
-
17
-
-
23844544682
-
-
S. Amira, D. Spangberg, K. Hermasson Phys. Chem. Chem. Phys., 2005, 7, 2874.
-
(2005)
Phys. Chem. Chem. Phys.
, vol.7
, pp. 2874
-
-
Amira, S.1
Spangberg, D.2
Hermasson, K.3
-
18
-
-
1642276658
-
-
J. Blumberger, L. Bernasconi, I. Tavernelli, R. Vuilleumier, M. Sprik J. Am. Chem. Soc., 2004, 126, 3928.
-
(2004)
J. Am. Chem. Soc.
, vol.126
, pp. 3928
-
-
Blumberger, J.1
Bernasconi, L.2
Tavernelli, I.3
Vuilleumier, R.4
Sprik, M.5
-
20
-
-
58149174187
-
-
K. J. de Almeida, N. A. Murugan, Z. Rinkevicius, H. W. Hugosson, O. Vahtras, H. Agren, A. Cesar Phys. Chem. Chem. Phys., 2009, 11, 508.
-
(2009)
Phys. Chem. Chem. Phys.
, vol.11
, pp. 508
-
-
De Almeida, K.J.1
Murugan, N.A.2
Rinkevicius, Z.3
Hugosson, H.W.4
Vahtras, O.5
Agren, H.6
Cesar, A.7
-
21
-
-
0030852233
-
-
A. Curioni, M. Sprik, W. Andreoni, H. Schiffer, J. Hutter, M. Parrinello J. Am. Chem. Soc., 1997, 119, 7218.
-
(1997)
J. Am. Chem. Soc.
, vol.119
, pp. 7218
-
-
Curioni, A.1
Sprik, M.2
Andreoni, W.3
Schiffer, H.4
Hutter, J.5
Parrinello, M.6
-
23
-
-
4243553426
-
-
A. D. Becke Phys. Rev. A: At., Mol., Opt. Phys., 1988, 38, 3098.
-
(1988)
Phys. Rev. A: At., Mol., Opt. Phys.
, vol.38
, pp. 3098
-
-
Becke, A.D.1
-
24
-
-
0345491105
-
-
C. Lee, W. Yang, R. G. Parr Phys. Rev. B: Condens. Matter, 1988, 37, 785.
-
(1988)
Phys. Rev. B: Condens. Matter
, vol.37
, pp. 785
-
-
Lee, C.1
Yang, W.2
Parr, R.G.3
-
25
-
-
4243943295
-
-
J. P. Perdew, K. Burke, M. Ernzerhof Phys. Rev. Lett., 1996, 77, 3865.
-
(1996)
Phys. Rev. Lett.
, vol.77
, pp. 3865
-
-
Perdew, J.P.1
Burke, K.2
Ernzerhof, M.3
-
29
-
-
85035245890
-
-
CPMD, Copyright IBM Corp 1990-2006, Copyright MPI für Festkörperforschung Stuttgart 1997-2001
-
CPMD, Copyright IBM Corp 1990-2006, Copyright MPI für Festkörperforschung Stuttgart 1997-2001
-
-
-
-
30
-
-
4243661501
-
-
E. A Carter, G. Ciccotti, J. T. Hynes, R. Kapral Chem. Phys. Lett., 1989, 156, 472.
-
(1989)
Chem. Phys. Lett.
, vol.156
, pp. 472
-
-
Carter, E.A.1
Ciccotti, G.2
Hynes, J.T.3
Kapral, R.4
-
34
-
-
84926127218
-
-
I. B. Bersuker, Cambridge University Press, Cambridge
-
The Jahn-Teller Effect, ed. I. B. Bersuker, Cambridge University Press, Cambridge, 2006
-
(2006)
The Jahn-Teller Effect
-
-
|