Structure of the thiolated Au130 cluster

Journal of Physical Chemistry A

Volumn 117, Issue 40, 2013, Pages 10470-10476

  Tlahuice Flores, Alfredo ^a   Santiago, Ulises ^a   Bahena, Daniel ^a   Vinogradova, Ekaterina ^a   Conroy, Cecil V ^b   Ahuja, Tarushee ^b   Bach, Stephan B H ^a   Ponce, Arturo ^c   Wang, Gangli ^b   José Yacamán, Miguel ^a   Whetten, Robert L ^a  

^a UNIVERSITY OF TEXAS AT SAN ANTONIO   (United States)

^b GEORGIA STATE UNIVERSITY   (United States)

^c NONE

Author keywords

[No Author keywords available]

Indexed keywords

ATOMIC-RESOLUTION IMAGING; DISULFIDE BRIDGE; DITHIOLATES; OPTIMIZED STRUCTURES; SCANNING/TRANSMISSION ELECTRON MICROSCOPY (STEM); SELECTIVE FORMATION; STRUCTURE MODELS; TIME-DEPENDENT DFT;

COVALENT BONDS; IMAGE RECONSTRUCTION;

OPTIMIZATION;

EID: 84885630931     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp406665m     Document Type: Article

References (34)

1. 18] J. Am. Chem. Soc. 2008, 130, 3754-3755
2. 25 Cluster and Optical Properties J. Am. Chem. Soc. 2008, 130, 5883-5885
3. 38 Nanoparticles J. Am. Chem. Soc. 2010, 132, 8280-8281
4. 24 Angew. Chem. 2012, 124, 13291-13295
5. Jadzinsky, P. D.; Calero, G.; Ackerson, C. J.; Bushnell, D. A.; Kornberg, R. D. Structure of a Thiol Monolayer-Protected Gold Nanoparticle at 1.1 Å Resolution Science 2007, 318, 430-433
6. 44: Its Unexpected Molecular Anatomy and Resulting Stereochemical and Bonding Consequences Small 2008, 4, 534-537
7. 102 Nanocluster ACS Nano 2008, 2, 1497-1503
8. Whetten, R. L.; Price, R. C. Nano-Golden Order Science 2007, 318, 407-408
9. Chaki, N. K.; Negishi, Y.; Tsunoyama, H.; Shichibu, Y.; Tsukuda, T. Ubiquitous 8 and 29 kDa Gold:alkanethiolate Cluster Compounds: Mass-Spectrometric Determination of Molecular Formulas and Structural Implications J. Am. Chem. Soc. 2008, 130, 8608-8610
10. 60 J. Phys. Chem. C 2009, 113, 5035-5038
11. 60 Nano Lett. 2009, 9, 4083-4087
12. 60 Cluster J. Phys. Chem. Lett. 2013, 4, 975-981
13. + J. Am. Chem. Soc. 2009, 131, 16266
14. Qian, H.; Zhu, Y.; Jin, R. Atomically Precise Gold Nanocrystal Molecules with Surface Plasmon Resonance Proc. Natl. Acad. Sci. U.S.A. 2012, 109, 696-700
15. 130 Nanoparticles with Discrete Core and Core-Ligand Energy States J. Am. Chem. Soc. 2011, 133, 16037-16044
16. Tang, Z. H.; Xu, B.; Wu, B. H.; Robinson, D. A.; Bokossa, N.; Wang, G. L. Monolayer Reactions of Protected Au Nanoclusters with Monothiol Tiopronin and 2,3-Dithiol Dimercaptopropanesulfonate Langmuir 2011, 27, 2989-299
17. Tang, Z.; Ahuja, T.; Wang, S.; Wang, G. Near Infrared Luminescence of Gold Nanoclusters Affected by the Bonding of 1,4-dithiolate Durene and Monothiolate Phenylethanethiolate Nanoscale 2012, 4, 4119-4124
18. 187 Clusters J. Phys. Chem. Lett. 2012, 3, 1624-1628
19. Perdew, P.; Burke, K.; Ernzerhof, M. Generalized Gradient Approximation Made Simple Phys. Rev. Lett. 1996, 77, 3865-3868
20. Troullier, N.; Martins, J. L. Efficient pseudopotentials for Plane-Wave Calculations Phys. Rev. B 1991, 43, 1993-2006
21. Soler, J. M.; Artacho, E.; Gale, J. D.; García, A.; Junquera, J.; Ordejón, P.; Sánchez-Portal, D. The SIESTA Method for Ab initio Order-N Materials Simulation J. Phys.: Condens. Matter 2002, 14, 2745-2779
22. Runge, E.; Gross, E. K. U. Density-Functional Theory for Time-Dependent Systems Phys. Rev. Lett. 1984, 52, 997-1000
23. Marques, M. A. L.; Castro, A.; Bertsch, G. F.; Rubio, A. octopus: a First-Principles Tool for Excited Electron-Ion Dynamics Comput. Phys. Commun. 2003, 151, 60-78
24. Castro, A.; Marques, M. A. L.; Appel, H.; Oliveira, M.; Rozzi, C.; Andrade, X.; Lorenzen, F.; Gross, E. K. U.; Rubio, A. octopus: A Tool for The Application of Time-Dependent Density Functional Theory Phys. Status Solidi B 2006, 243, 2465-2488
25. Perdew, J. P.; Zunger, A. Self-interaction Correction to Density-Functional Approximations for Many-Electron Systems Phys. Rev. B 1981, 23, 5048-5079
26. 18 Nanomolecules: A Combined Mass Spectrometric and Computational Study J. Am. Chem. Soc. 2011, 133, 20258-20266
27. 18 Clusters J. Phys. Chem. C 2013, 10.1021/jp407150t
28. Gómez-Rodríguez, A.; Beltrán-del-Río, L. M.; Herrera-Becerra, R. SimulaTEM: Multislice Simulations for General Objects Ultramicroscopy 2010, 110, 95-104
29. Williams, P. Motion of Small Gold Clusters in the Electron Microscope Appl. Phys. Lett. 1987, 50, 1760-1762
30. Ben-David, T.; Lereah, Y.; Deutscher, G.; Penisson, J.; Bourret, A.; Kofman, R.; Cheyssac, P. Correlated Orientations in Nanocrystal Fluctuations Phys. Rev. Lett. 1997, 78, 2585-2587
31. Be'er, A.; Kofman, R.; Phillipp, F.; Lereah, Y. Spontaneous Crystallographic Instabilities of Pb Nanoparticles in a SiO Matrix Phys. Rev. B 2007, 76, 075410-1-075410-5
32. Koch, C. T. Ph.D. Thesis, Arizona State University, Phoenix, Arizona, 2002.
33. [z] Phys. Chem. Chem. Phys. 2013, 101039/C3CP53902D
34. Lopez-Lozano, X.; Mottet, C.; Weissker, H.-Ch. Effect of Alloying on the Optical Properties of Ag-Au Nanoparticles J. Phys. Chem. C 2013, 117, 3062-3068