Trends in the structure and bonding of noble metal clusters
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J. Soler | E. M. Fernández | I. L. Garzón | José M. Soler | Ignacio L. Garzón | Luis Carlos Balbás | Eva M. Fernández | L. Balbás | I. Garzón
[1] M. Kappes,et al. Photodissociation spectroscopy of Ag4+(N2)m, m=0–4 , 2000 .
[2] Leonard Kleinman,et al. Efficacious Form for Model Pseudopotentials , 1982 .
[3] Joe Ho,et al. Photoelectron spectroscopy of mass-selected metal cluster anions. I. Cu−n, n=1–10 , 1987 .
[4] Hannu Häkkinen,et al. Bonding in Cu, Ag, and Au clusters: relativistic effects, trends, and surprises. , 2002, Physical review letters.
[5] O. Gunnarsson,et al. Electronic and Geometric Structure of small mass selected Clusters , 1995 .
[6] J. A. Reyes-Nava,et al. Chirality, defects, and disorder in gold clusters , 2003 .
[7] C. Walther,et al. The interaction of gold clusters with methanol molecules: Infrared photodissociation of mass-selected Aun+(CH3OH)m , 2000 .
[8] H. Möller,et al. COMPARISON OF PHOTOELECTRON SPECTRA OF ${\rm Cu}_n^-$, ${\rm Ag}_n^-$, AND ${\rm Na}_n^-$: MOLECULAR ORBITALS VERSUS ELECTRONIC SHELLS , 1996 .
[9] D. Sánchez-Portal,et al. The SIESTA method for ab initio order-N materials simulation , 2001, cond-mat/0111138.
[10] I. L. Garzón,et al. Ab initio study of small gold clusters , 1999 .
[11] Jiří Pittner,et al. Effective core potential‐configuration interaction study of electronic structure and geometry of small anionic Agn clusters: Predictions and interpretation of photodetachment spectra , 1994 .
[12] L. Schweikhard,et al. Energy dependence of the decay pathways of optically excited small gold clusters , 2001 .
[13] K. Hansen,et al. Formation and fragmentation of negative metal clusters , 2001 .
[14] J. Junquera,et al. Systematic generation of finite-range atomic basis sets for linear-scaling calculations , 2002 .
[15] Joe Ho,et al. Photoelectron spectroscopy of metal cluster anions : Cu−n, Ag−n, and Au−n , 1990 .
[16] D. Marx,et al. The interaction of gold clusters with methanol molecules: Ab initio molecular dynamics of Au n CH 3 OH and Au n CH 3 OH , 2000 .
[17] M. Morse. Clusters of transition-metal atoms , 1986 .
[18] Maofa Ge,et al. Geometrical and electronic structures of gold, silver, and gold-silver binary clusters: Origins of ductility of gold and gold-silver alloy formation , 2003 .
[19] Pekka Pyykkö,et al. Relativistic effects in structural chemistry , 1988 .
[20] D. Goodman,et al. Onset of catalytic activity of gold clusters on titania with the appearance of nonmetallic properties , 1998, Science.
[21] Jan M. van Ruitenbeek,et al. Quantum properties of atomic-sized conductors , 2002, cond-mat/0208239.
[22] K. Balasubramanian,et al. ELECTRONIC STATES AND POTENTIAL ENERGY SURFACES OF GOLD AND SILVER TRIMERS , 1988 .
[23] Jose Luis Martins,et al. Evaluation of exchange-correlation energy, potential, and stress , 2001 .
[24] Hannu Häkkinen,et al. On the Electronic and Atomic Structures of Small AuN- (N = 4−14) Clusters: A Photoelectron Spectroscopy and Density-Functional Study , 2003 .
[25] N. Papanikolaou,et al. Broken-bond rule for the surface energies of noble metals , 2001 .
[26] H. Möller,et al. Delocalized electronic states in small clusters : comparison of Nan, Cun, Agn, and Aun clusters , 1994 .
[27] C. Walther,et al. TIME-RESOLVED PHOTOFRAGMENTATION OF STORED SILVER CLUSTERS AGN+ (N = 8-21) , 1998 .
[28] W. Andreoni,et al. Structural and electronic properties of sodium microclusters (n=2–20) at low and high temperatures: New insights from ab initio molecular dynamics studies , 1991 .
[29] K. J. Taylor,et al. Ultraviolet photoelectron spectra of coinage metal clusters , 1992 .
[30] D. Sánchez-Portal,et al. Metallic bonding and cluster structure , 2000 .
[31] P. Pyykkö. Relativity, gold, closed-shell interactions, and CsAu.NH3. , 2002, Angewandte Chemie.
[32] C. Klots. Evaporation from small particles , 1988 .
[33] I. G. Kaplan,et al. A comparative theoretical study of stable geometries and energetic properties of small silver clusters , 1994 .
[34] R. Smalley,et al. Ultraviolet photoelectron spectroscopy of copper clusters , 1988 .
[35] V. Spasov,et al. Threshold collision-induced dissociation of anionic copper clusters and copper cluster monocarbonyls , 2000 .
[36] R. Fournier. Theoretical study of the structure of silver clusters , 2001 .
[37] D. Sánchez-Portal,et al. Lowest Energy Structures of Gold Nanoclusters , 1998 .
[38] Pekka Pyykkö,et al. Relativity and the periodic system of elements , 1979 .
[39] Structure and properties of small sodium clusters , 2001, physics/0112038.
[40] Patrick Weis,et al. Structures of small gold cluster cations (Aun+, n<14): Ion mobility measurements versus density functional calculations , 2002 .
[41] Uzi Landman,et al. Gold clusters(AuN,2<~N<~10)and their anions , 2000 .
[42] Jun Li,et al. Au20: A Tetrahedral Cluster , 2003, Science.
[43] Christoph R. Jacob,et al. The structures of small gold cluster anions as determined by a combination of ion mobility measurements and density functional calculations , 2002 .
[44] I. L. Garzón,et al. Non-additive effects in small gold clusters , 1999 .
[45] M. Moseler,et al. Symmetry and electronic structure of noble-metal nanoparticles and the role of relativity. , 2004, Physical review letters.
[46] C. Walther,et al. Dissociation pathways of doubly and triply charged gold clusters , 1998 .
[47] T. Bierweiler,et al. Structures of small silver cluster cations (Agn+, n<12): ion mobility measurements versus density functional and MP2 calculations , 2002 .
[48] R. Mitrić,et al. Ab initio study of the absorption spectra of Agn (n=5–8) clusters , 2001 .
[49] Martins,et al. Efficient pseudopotentials for plane-wave calculations. , 1991, Physical review. B, Condensed matter.
[50] J. Joannopoulos,et al. Structural patterns of unsupported gold clusters , 2001 .
[51] Burke,et al. Generalized Gradient Approximation Made Simple. , 1996, Physical review letters.
[52] J. Pittner,et al. Structural and optical properties of small oxygen-doped- and pure-silver clusters , 1999 .
[53] J. Pittner,et al. An accurate relativistic effective core potential for excited states of Ag atom: An application for studying the absorption spectra of Agn and Agn+ clusters , 1999 .
[54] P. Schwerdtfeger,et al. Relativistic coupled cluster calculations for neutral and singly charged Au3 clusters , 2000 .
[55] M. Knickelbein,et al. Infrared Studies of the Interaction of Methanol with Cun, Agn, and Aun , 1998 .
[56] Amorphous structures of Cu, Ag, and Au nanoclusters from first principles calculations , 2002 .
[57] A. Toro‐Labbé,et al. Characterization of copper clusters through the use of density functional theory reactivity descriptors , 2002 .
[58] B. Hammer,et al. Active role of oxide support during CO oxidation at Au/MgO. , 2003, Physical review letters.
[59] P. Calaminici,et al. Structure and stability of small copper clusters , 2002 .
[60] Notker Rösch,et al. From clusters to bulk: A relativistic density functional investigation on a series of gold clusters Aun, n=6,…,147 , 1997 .
[61] P. Wormer,et al. Density functional calculations of molecular hyperfine interactions in the zero order regular approximation for relativistic effects , 1998 .
[62] Yang Shi,et al. Time-resolved photodissociation and threshold collision-induced dissociation of anionic gold clusters , 2000 .
[63] J. Koutecký,et al. Effective core potential‐configuration interaction study of electronic structure and geometry of small neutral and cationic Agn clusters: Predictions and interpretation of measured properties , 1993 .
[64] J. A. Reyes-Nava,et al. Chirality in bare and passivated gold nanoclusters , 2002, physics/0203078.
[65] W. Andreoni,et al. Gold and platinum microclusters and their anions: comparison of structural and electronic properties , 2000 .
[66] Alfredo Pasquarello,et al. Structural and Electronic-Properties of Small Copper Clusters - a First Principles Study , 1995 .
[67] Jinlong Yang,et al. Theoretical study of small two-dimensional gold clusters , 2003 .
[68] E. Janssens,et al. Two-dimensional magic numbers in mass abundances of photofragmented bimetallic clusters , 2003 .
[70] Perdew,et al. Size-dependent ionization energy of a metallic cluster: Resolution of the classical image-potential paradox. , 1994, Physical review. B, Condensed matter.
[71] Jaroslav V. Burda,et al. Density functional study of structural and electronic properties of bimetallic silver–gold clusters: Comparison with pure gold and silver clusters , 2002 .
[72] W. Eberhardt. Clusters as new materials , 2002 .
[73] Karo Michaelian,et al. Structure and energetics of Ni, Ag, and Au nanoclusters , 1999 .
[74] L. Schweikhard,et al. Dimer dissociation energies of small odd-size clusters , 2002 .
[75] Jijun Zhao,et al. Density-functional study of Au n ( n = 2 – 2 0 ) clusters: Lowest-energy structures and electronic properties , 2002 .
[76] S. Youn,et al. Effect of dimensionality on the electronic structure of Cu, Ag, and Au , 2003 .
[77] Jinlan Wang,et al. Structures and electronic properties of Cu20, Ag20, and Au20 clusters with density functional method , 2003 .