-
1
-
-
33644698140
-
13 (M = Pt and Au) clusters on graphene sheets and flakes
-
DOI 10.1016/j.cplett.2006.01.007, PII S0009261406000340
-
Y. Okamoto 2006 Chem. Phys. Lett. 420 382 10.1016/j.cplett.2006.01.007 2006CPL...420..382O (Pubitemid 43332858)
-
(2006)
Chemical Physics Letters
, vol.420
, Issue.4-6
, pp. 382-386
-
-
Okamoto, Y.1
-
2
-
-
34347374301
-
-
10.1103/PhysRevB.75.235405 2007PhRvB.75w5405W
-
L.-L. Wang D.D. Johnson 2007 Phys. Rev. B 75 235405 10.1103/PhysRevB.75. 235405 2007PhRvB..75w5405W
-
(2007)
Phys. Rev. B
, vol.75
, pp. 235405
-
-
Wang, L.-L.1
Johnson, D.D.2
-
3
-
-
65549140346
-
-
10.1103/PhysRevA.79.043203 2009PhRvA.79d3203Z
-
M. Zhang R. Fournie 2009 Phys. Rev. A 79 043203 10.1103/PhysRevA.79. 043203 2009PhRvA..79d3203Z
-
(2009)
Phys. Rev. A
, vol.79
, pp. 043203
-
-
Zhang, M.1
Fournie, R.2
-
4
-
-
33750020291
-
First-principles study of intermediate size silver clusters: Shape evolution and its impact on cluster properties
-
DOI 10.1063/1.2351818
-
M. Yang K.A. Jackson J. Jellinek 2006 J. Chem. Phys. 125 144308 10.1063/1.2351818 2006JChPh.125n4308Y (Pubitemid 44570785)
-
(2006)
Journal of Chemical Physics
, vol.125
, Issue.14
, pp. 144308
-
-
Yang, M.1
Jackson, K.A.2
Jellinek, J.3
-
7
-
-
13844281675
-
Trends in the structure and bonding of neutral and charged noble metal clusters
-
DOI 10.1002/qua.20331, Proceedings of the Tenth International Conference on the Applications of Density Functional Theory in Chemistry and Physics - Part II of II
-
E.M. Fernández J.M. Soler I.L. Garzón L.C. Balbás 2005 Int. J. Quantum Chem. 101 740 10.1002/qua.20331 (Pubitemid 40253449)
-
(2005)
International Journal of Quantum Chemistry
, vol.101
, Issue.6
, pp. 740-745
-
-
Fernandez, E.M.1
Soler, J.M.2
Garzon, I.L.3
Balbas, L.C.4
-
8
-
-
18144373147
-
Evolution of small copper clusters and dissociative chemisorption of hydrogen
-
DOI 10.1103/PhysRevLett.94.026103, 026103
-
G.H. Guvelioglu P. Ma X. He R.C. Forrey H. Cheng 2005 Phys. Rev. Lett. 94 26103 10.1103/PhysRevLett.94.026103 2005PhRvL..94b6103G (Pubitemid 40620163)
-
(2005)
Physical Review Letters
, vol.94
, Issue.2
, pp. 1-4
-
-
Guvelioglu, G.H.1
Ma, P.2
He, X.3
Forrey, R.C.4
Cheng, H.5
-
9
-
-
23944475643
-
Growth behaviors and electronic structures of Na and Cu nanoclusters: The role of sp-d hybridization
-
DOI 10.1142/S0217979205031080
-
M. Itoh V. Kumar Y. Kawazoe 2005 Int. J. Mod. Phys. B 19 2421 10.1142/S0217979205031080 2005IJMPB..19.2421I (Pubitemid 41195704)
-
(2005)
International Journal of Modern Physics B
, vol.19
, Issue.15-17
, pp. 2421-2426
-
-
Itoh, M.1
Kumar, V.2
Kawazoe, Y.3
-
12
-
-
0001665604
-
-
10.1103/PhysRevA.60.3053 1999PhRvA.60.3053E
-
Erkoç R. Shaltaf 1999 Phys. Rev. A 60 3053 10.1103/PhysRevA.60. 3053 1999PhRvA..60.3053E
-
(1999)
Phys. Rev. A
, vol.60
, pp. 3053
-
-
Erkoç1
Shaltaf, R.2
-
15
-
-
0001065723
-
n clusters using generalized-gradient approximations within density functional theory
-
DOI 10.1063/1.477313, PII S0021960698302408
-
C. Massobrio A. Pasquarello A.D. Corso 1998 J. Chem. Phys. 109 6626 10.1063/1.477313 1998JChPh.109.6626M (Pubitemid 128678290)
-
(1998)
Journal of Chemical Physics
, vol.109
, Issue.16
, pp. 6626-6630
-
-
Massobrio, C.1
Pasquarello, A.2
Dal Corso, A.3
-
20
-
-
0345491105
-
-
10.1103/PhysRevB.37.785 1988PhRvB.37.785L
-
C. Lee W. Yang R.G. Parr 1988 Phys. Rev. B 37 785 10.1103/PhysRevB.37.785 1988PhRvB..37..785L
-
(1988)
Phys. Rev. B
, vol.37
, pp. 785
-
-
Lee, C.1
Yang, W.2
Parr, R.G.3
-
26
-
-
77951938161
-
-
TURBOMOLE 5.9, Quantum Chemisty Group, University of Karlsruhe, Germany
-
TURBOMOLE 5.9, Quantum Chemisty Group, University of Karlsruhe, Germany
-
-
-
-
27
-
-
26444569404
-
Systematically convergent basis sets for transition metals. II. Pseudopotential-based correlation consistent basis sets for the group 11 (Cu, Ag, Au) and 12 (Zn, Cd, Hg) elements
-
DOI 10.1007/s00214-005-0681-9
-
K.A. Peterson C. Puzzarini 2005 Theor. Chem. Acc. 114 283 10.1007/s00214-005-0681-9 (Pubitemid 41430492)
-
(2005)
Theoretical Chemistry Accounts
, vol.114
, Issue.4-5
, pp. 283-296
-
-
Peterson, K.A.1
Puzzarini, C.2
-
29
-
-
36549103818
-
-
10.1063/1.450689 1986JChPh.84.6840H
-
K. Hurley 1986 J. Chem. Phys. 84 6840 10.1063/1.450689 1986JChPh..84.6840H
-
(1986)
J. Chem. Phys.
, vol.84
, pp. 6840
-
-
Hurley, K.1
-
36
-
-
0342726388
-
-
10.1016/0009-2614(92)85440-L 1992CPL.192.129K
-
M.B. Knickelbein 1992 Chem. Phys. Lett. 192 129 10.1016/0009-2614(92) 85440-L 1992CPL...192..129K
-
(1992)
Chem. Phys. Lett.
, vol.192
, pp. 129
-
-
Knickelbein, M.B.1
-
39
-
-
34247351609
-
-
10.1103/PhysRevB.75.155422 2007PhRvB.75o5422W
-
J. Wang 2007 Phys. Rev. B 75 155422 10.1103/PhysRevB.75.155422 2007PhRvB..75o5422W
-
(2007)
Phys. Rev. B
, vol.75
, pp. 155422
-
-
Wang, J.1
-
40
-
-
57749090225
-
-
10.1103/PhysRevB.78.245404 2008PhRvB.78x5404S
-
R. Singh P. Kroll 2008 Phys. Rev. B 78 245404 10.1103/PhysRevB.78.245404 2008PhRvB..78x5404S
-
(2008)
Phys. Rev. B
, vol.78
, pp. 245404
-
-
Singh, R.1
Kroll, P.2
-
43
-
-
35949005288
-
-
10.1103/RevModPhys.65.677 1993RvMP.65.677B
-
M. Brack 1993 Rev. Mod. Phys. 65 677 10.1103/RevModPhys.65.677 1993RvMP...65..677B
-
(1993)
Rev. Mod. Phys.
, vol.65
, pp. 677
-
-
Brack, M.1
|