Temperature- and pressure-dependent hydrogen concentration in supported PdHx nanoparticles by Pd K-edge X-ray absorption spectroscopy

Journal of Physical Chemistry C

Volumn 118, Issue 19, 2014, Pages 10416-10423

  Bugaev, Aram L ^a   Guda, Alexander A ^a   Lomachenko, Kirill A ^a,b   Srabionyan, Vasiliy V ^a   Bugaev, Lusegen A ^a   Soldatov, Alexander V ^a   Lamberti, Carlo ^a,b   Dmitriev, Vladimir P ^c   Van Bokhoven, Jeroen A ^d,e  

^a SOUTHERN FEDERAL UNIVERSITY   (Russian Federation)

^b UNIVERSITY OF TURIN   (Italy)

^c EUROPEAN SYNCHROTRON RADIATION FACILITY   (France)

^d ETH ZURICH   (Switzerland)

^e PAUL SCHERRER INSTITUTE   (Switzerland)

Author keywords

[No Author keywords available]

Indexed keywords

NANOPARTICLES; X RAY ABSORPTION SPECTROSCOPY; X RAY DIFFRACTION;

CALIBRATION PROCEDURE; EFFECT OF HYDROGEN; EXPERIMENTAL TECHNIQUES; HYDROGEN CONCENTRATION; HYDROGEN PRESSURES; INTER-ATOMIC DISTANCES; PALLADIUM NANOPARTICLES; THEORETICAL SIMULATION;

HYDROGEN;

EID: 84900805539     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp500734p     Document Type: Article

References (98)

1. Astruc, D.; Lu, F.; Aranzaes, J. R. Nanoparticles as recyclable catalysts: The frontier between homogeneous and heterogeneous catalysis Angew. Chem., Int. Ed. 2005, 44, 7852-7872
2. Watanabe, K.; Menzel, D.; Nilius, N.; Freund, H. J. Photochemistry on metal nanoparticles Chem. Rev. 2006, 106, 4301-4320
3. Singh, J.; Lamberti, C.; van Bokhoven, J. A. Advanced X-ray absorption and emission spectroscopy: in situ catalytic studies Chem. Soc. Rev. 2010, 39, 4754-4766
4. Frenkel, A. I. Applications of extended X-ray absorption fine-structure spectroscopy to studies of bimetallic nanoparticle catalysts Chem. Soc. Rev. 2012, 41, 8163-8178
5. Bordiga, S.; Groppo, E.; Agostini, G.; van Bokhoven, J. A.; Lamberti, C. Reactivity of surface species in heterogeneous catalysts probed by in situ X-ray absorption techniques Chem. Rev. 2013, 113, 1736-1850
6. Mino, L.; Agostini, G.; Borfecchia, E.; Gianolio, D.; Piovano, A.; Gallo, E.; Lamberti, C. Low-dimensional systems investigated by x-ray absorption spectroscopy: a selection of 2D, 1D and 0D cases J. Phys. D: Appl. Phys. 2013, 46, 423001
7. Bonacickoutecky, V.; Fantucci, P.; Koutecky, J. Quantum-chemistry of small clusters of elements of group-Ia, group-Ib, and group-Iia-Fundamental- concepts, predictions, and interpretation of experiments Chem. Rev. 1991, 91, 1035-1108
8. Baletto, F.; Ferrando, R. Structural properties of nanoclusters: Energetic, thermodynamic, and kinetic effects Rev. Mod. Phys. 2005, 77, 371-423
9. Morton, S. M.; Silverstein, D. W.; Jensen, L. Theoretical studies of plasmonics using electronic structure methods Chem. Rev. 2011, 111, 3962-3994
10. Agostini, G.; Bertinetti, L.; Piovano, A.; Pellegrini, R.; Leofanti, G.; Groppo, E.; Lamberti, C. The effect of different fcc nanoparticle distributions on particle size and surface area determination: a theoretical study J. Phys. Chem. C 2014, 118, 4085-4094
11. Crooks, R. M.; Zhao, M. Q.; Sun, L.; Chechik, V.; Yeung, L. K. Dendrimer-encapsulated metal nanoparticles: Synthesis, characterization, and applications to catalysis Acc. Chem. Res. 2001, 34, 181-190
12. Moreno-Manas, M.; Pleixats, R. Formation of carbon-carbon bonds under catalysis by transition-metal nanoparticles Acc. Chem. Res. 2003, 36, 638-643
13. Eustis, S.; El-Sayed, M. A. Why gold nanoparticles are more precious than pretty gold: Noble metal surface plasmon resonance and its enhancement of the radiative and nonradiative properties of nanocrystals of different shapes Chem. Soc. Rev. 2006, 35, 209-217
14. Shylesh, S.; Schunemann, V.; Thiel, W. R. Magnetically separable nanocatalysts: Bridges between homogeneous and heterogeneous catalysis Angew. Chem., Int. Ed. 2010, 49, 3428-3459
15. Bordiga, S.; Groppo, E.; Agostini, G.; van Bokhoven, J. A.; Lamberti, C. Reactivity of surface species in heterogeneous catalysts probed by in situ X-ray absorption techniques Chem. Rev. 2013, 113, 1736-1850
16. Murray, R. W. Nanoelectrochemistry: Metal nanoparticles, nanoelectrodes, and nanopores Chem. Rev. 2008, 108, 2688-2720
17. Jain, P. K.; Huang, X. H.; El-Sayed, I. H.; El-Sayed, M. A. Noble metals on the nanoscale: optical and photothermal properties and some applications in imaging, sensing, biology, and medicine Acc. Chem. Res. 2008, 41, 1578-1586
18. Murphy, C. J.; Gole, A. M.; Stone, J. W.; Sisco, P. N.; Alkilany, A. M.; Goldsmith, E. C.; Baxter, S. C. Gold nanoparticles in biology: beyond toxicity to cellular imaging Acc. Chem. Res. 2008, 41, 1721-1730
19. Anker, J. N.; Hall, W. P.; Lyandres, O.; Shah, N. C.; Zhao, J.; Van Duyne, R. P. Biosensing with plasmonic nanosensors Nat. Mater. 2008, 7, 442-453
20. Hu, M.; Chen, J. Y.; Li, Z. Y.; Au, L.; Hartland, G. V.; Li, X. D.; Marquez, M.; Xia, Y. N. Gold nanostructures: engineering their plasmonic properties for biomedical applications Chem. Soc. Rev. 2006, 35, 1084-1094
21. El-Sayed, I. H.; Huang, X. H.; El-Sayed, M. A. Surface plasmon resonance scattering and absorption of anti-EGFR antibody conjugated gold nanoparticles in cancer diagnostics: Applications in oral cancer Nano Lett. 2005, 5, 829-834
22. Lal, S.; Clare, S. E.; Halas, N. J. Nanoshell-enabled photothermal cancer therapy: impending clinical impact Acc. Chem. Res. 2008, 41, 1842-1851
23. Frenkel, A. I.; Hills, C. W.; Nuzzo, R. G. A view from the inside: Complexity in the atomic scale ordering of supported metal nanoparticles J. Phys. Chem. B 2001, 105, 12689-12703
24. Knecht, M. R.; Weir, M. G.; Frenkel, A. I.; Crooks, R. M. Structural rearrangement of bimetallic alloy PdAu nanoparticles within dendrimer templates to yield core/shell configurations Chem. Mater. 2008, 20, 1019-1028
25. Cuenya, B. R.; Croy, J. R.; Mostafa, S.; Behafarid, F.; Li, L.; Zhang, Z. F.; Yang, J. C.; Wang, Q.; Frenkel, A. I. Solving the structure of size-selected Pt nanocatalysts synthesized by inverse micelle encapsulation J. Am. Chem. Soc. 2010, 132, 8747-8756
26. Frenkel, A. I.; Yevick, A.; Cooper, C.; Vasic, R. Modeling the structure and composition of nanoparticles by extended X-ray absorption fine-structure spectroscopy Annu. Rev. Anal. Chem. 2011, 4, 23-39
27. Li, Y. M.; Liu, J. H. C.; Witham, C. A.; Huang, W. Y.; Marcus, M. A.; Fakra, S. C.; Alayoglu, P.; Zhu, Z. W.; Thompson, C. M.; Arjun, A.; Lee, K.; Gross, E.; Toste, F. D.; Somorjai, G. A. A Pt-cluster-based heterogeneous catalyst for homogeneous catalytic reactions: X-ray absorption spectroscopy and reaction kinetic studies of their activity and stability against leaching J. Am. Chem. Soc. 2011, 133, 13527-13533
28. Anderson, R. M.; Zhang, L.; Loussaert, J. A.; Frenkel, A. I.; Henkelman, G.; Crooks, R. M. An experimental and theoretical investigation of the inversion of Pd@Pt core@shell dendrimer-encapsulated nanoparticles ACS Nano 2013, 7, 9345-9353
29. Tungler, A.; Tarnai, T.; Hegedus, L.; Fodor, K.; Máthé, T. Palladium-mediated heterogeneous catalytic hydrogenations: selectivity of liquid-phase reactions for the fine chemicals industry Platinum Met. Rev. 1998, 42, 108-115
30. 3 catalysts in series China Pet. Process. Petrochem. Technol. 2012, 14, 83-89
31. Gelin, P.; Primet, M. Complete oxidation of methane at low temperature over noble metal based catalysts: a review Appl. Catal., B 2002, 39, 1-37
32. Lampert, J. K.; Kazi, M. S.; Farrauto, R. J. Palladium catalyst performance for methane emissions abatement from lean burn natural gas vehicles Appl. Catal., B 1997, 14, 211-223
33. Liotta, L. F. Catalytic oxidation of volatile organic compounds on supported noble metals Appl. Catal., B 2010, 100, 403-412
34. Pellegrini, R.; Agostini, G.; Groppo, E.; Piovano, A.; Leofanti, G.; Lamberti, C. 0.5 wt.% Pd/C catalyst for purification of terephthalic acid: Irreversible deactivation in industrial plants J. Catal. 2011, 280, 150-160
35. Pernicone, N.; Cerboni, M.; Prelazzi, G.; Pinna, F.; Fagherazzi, G. An investigation on Pd/C industrial catalysts for the purification of terephthalic acid Catal. Today 1998, 44, 129-135
36. Blaser, H. U.; Indolese, A.; Schnyder, A.; Steiner, H.; Studer, M. Supported palladium catalysts for fine chemicals synthesis J. Mol. Catal. A: Chem. 2001, 173, 3-18
37. Garrett, C. E.; Prasad, K. The art of meeting palladium specifications in active pharmaceutical ingredients produced by Pd-catalyzed reactions Adv. Synth. Catal. 2004, 346, 889-900
38. Torborg, C.; Beller, M. Recent applications of palladium-catalyzed coupling reactions in the pharmaceutical, agrochemical, and fine chemical industries Adv. Synth. Catal. 2009, 351, 3027-3043
39. Chase, Z. A.; Fulton, J. L.; Camaioni, D. M.; Mei, D.; Balasubramanian, M.; Pham, V.-T.; Zhao, C.; Weber, R. S.; Wang, Y.; Lercher, J. A. State of supported pd during catalysis in water J. Phys. Chem. C 2013, 117, 17603-17612
40. Haug, K.; Buergi, T.; Trautman, T.; Ceyer, S. Distinctive reactivities of surface-bound H and bulk H for the catalytic hydrogenation of acetylene J. Am. Chem. Soc. 1998, 120, 8885-8886
41. 3 Science 1992, 257, 223-225
42. Teschner, D.; Borsodi, J.; Wootsch, A.; Revay, Z.; Havecker, M.; Knop-Gericke, A.; Jackson, S. D.; Schlögl, R. The roles of subsurface carbon and hydrogen in palladium-catalyzed alkyne hydrogenation Science 2008, 320, 86-89
43. Ingham, B.; Toney, M. F.; Hendy, S. C.; Cox, T.; Fong, D. D.; Eastman, J. A.; Fuoss, P. H.; Stevens, K. J.; Lassesson, A.; Brown, S. Particle size effect of hydrogen-induced lattice expansion of palladium nanoclusters Phys. Rev. B 2008, 78, 245408-245412
44. 4 Surf. sci. 2005, 588, L209-L219
45. 3 ACS Catal. 2014, 4, 187-194
46. 3 catalysts J. Catal. 2012, 287, 44-54
47. Groppo, E.; Agostini, G.; Borfecchia, E.; Wei, L.; Giannici, F.; Portale, G.; Longo, A.; Lamberti, C. Formation and growth of Pd nanoparticles inside a highly cross-linked polystyrene support: role of the reducing agent J. Phys. Chem. C 2014, 118, 8406-8415
48. Langhammer, C.; Larsson, E. M.; Kasemo, B.; Zoric, I. Indirect nanoplasmonic sensing: ultrasensitive experimental platform for nanomaterials science and optical nanocalorimetry Nano Lett. 2010, 10, 3529-3538
49. Yamauchi, M.; Ikeda, R.; Kitagawa, H.; Takata, M. Nanosize effects on hydrogen storage in palladium J. Phys. Chem. C 2008, 112, 3294-3299
50. Bérubé, V.; Radtke, G.; Dresselhaus, M.; Chen, G. Size effects on the hydrogen storage properties of nanostructured metal hydrides: a review Int. J. Energy Res. 2007, 31, 637-663
51. Jobic, H.; Renouprez, A. Formation of hydrides in small particles of palladium supported in Y-zeolite J. Less-Common Met. 1987, 129, 311-316
52. Narehood, D.; Kishore, S.; Goto, H.; Adair, J.; Nelson, J.; Gutierrez, H.; Eklund, P. X-ray diffraction and H-storage in ultra-small palladium particles Int. J. Hydrogen Energy 2009, 34, 952-960
53. Tew, M. W.; Miller, J. T.; van Bokhoven, J. A. Particle size effect of hydride formation and surface hydrogen adsorption of nanosized palladium catalysts: L-3 edge vs K edge X-ray absorption spectroscopy J. Phys. Chem. C 2009, 113, 15140-15147
54. Langhammer, C.; Zhdanov, V. P.; Zorić, I.; Kasemo, B. Size-dependent hysteresis in the formation and decomposition of hydride in metal nanoparticles Chem. Phys. Lett. 2010, 488, 62-66
55. Langhammer, C.; Zhdanov, V. P.; Zorić, I.; Kasemo, B. Size-dependent kinetics of hydriding and dehydriding of Pd nanoparticles Phys. Rev. Lett. 2010, 104, 135502-135504
56. Zhdanov, V. P.; Kasemo, B. Kinetics of the formation of a new phase in nanoparticles Chem. Phys. Lett. 2008, 460, 158-161
57. Suleiman, M.; Jisrawi, N.; Dankert, O.; Reetz, M.; Bähtz, C.; Kirchheim, R.; Pundt, A. Phase transition and lattice expansion during hydrogen loading of nanometer sized palladium clusters J. Alloys Compd. 2003, 356, 644-648
58. Vogel, W.; He, W.; Huang, Q.-H.; Zou, Z.; Zhang, X.-G.; Yang, H. Palladium nanoparticles "breathe" hydrogen; a surgical view with X-ray diffraction Int. J. Hydrogen Energy 2010, 35, 8609-8620
59. Agostini, G.; Pellegrini, R.; Leofanti, G.; Bertinetti, L.; Bertarione, S.; Groppo, E.; Zecchina, A.; Lamberti, C. Determination of the particle size, available surface area, and nature of exposed sites for silica- alumina-supported Pd nanoparticles: A multitechnical approach J. Phys. Chem. C 2009, 113, 10485-10492
60. Davis, R.; Landry, S.; Horsley, J.; Boudart, M. X-ray-absorption study of the interaction of hydrogen with clusters of supported palladium Phys. Rev. B 1989, 39, 10580-10583
61. McCaulley, J. A. In-situ X-ray absorption spectroscopy studies of hydride and carbide formation in supported palladium catalysts J. Phys. Chem. 1993, 97, 10372-10379
62. Scarano, D.; Bordiga, S.; Lamberti, C.; Ricchiardi, G.; Bertarione, S.; Spoto, G. Hydrogen adsorption and spill-over effects on H-Y and Pd-containing Y zeolites Appl. Catal., A 2006, 307, 3-12
63. Bianconi, A.; Soldatov, A. V.; Ivanchenko, T. I. Confirmation of hydrogen-induced unoccupied states in PdH: multiple-scattering analysis of palladium L1 and L3 XANES Nucl. Instrum. Methods, A 1991, 308, 248-250
64. 0.6 films: Evidence for hydrogen induced unoccupied states Solid State Commun. 1989, 71, 383-390
65. Ruckman, M.; Reisfeld, G.; Jisrawi, N.; Weinert, M.; Strongin, M.; Wiesmann, H.; Croft, M.; Sahiner, A.; Sills, D.; Ansari, P. XANES study of hydrogen incorporation in a Pd-capped Nb thin film Phys. Rev. B 1998, 57, 3881-3886
66. Soldatov, A.; Della Longa, S.; Bianconi, A. Relevant role of hydrogen atoms in the XANES of Pd hydride: Evidence of hydrogen induced unoccupied states Solid State Commun. 1993, 85, 863-868
67. 3 edge XANES investigation of the electronic and geometric structure of Pd/Ag-H membranes Phys. Chem. Chem. Phys. 2004, 6, 3903-3906
68. 4 J. Phys. Chem. C 2007, 111, 11721-11725
69. D'Angelo, P.; Pavel, N. V. EXAFS and molecular dynamics studies of ionic solutions J. Synchrotron Radiat. 2001, 8, 173-177
70. 2+ aqueous solutions Phys. Rev. B 2002, 66 064209
71. 2+ aqueous solutions: An X-ray absorption fine structure and molecular dynamics study J. Am. Chem. Soc. 2002, 124, 1958-1967
72. 2+ in aqueous solutions J. Am. Chem. Soc. 2002, 124, 1968-1976
73. 2+ K-edge of hydrated calcium ion J. Phys. Chem. B 2004, 108, 11857-11865
74. D'Angelo, P.; Benfatto, M. Effect of multielectronic configurations on the XAFS analysis at the FeK edge J. Phys. Chem. A 2004, 108, 4505-4514
75. 2+ ions on the structure of liquid water J. Phys. Chem. A 2011, 115, 4798-4803
76. 2+ ion in water at high pressure Inorg. Chem. 2013, 52, 1141-1150
77. D'Angelo, P.; Migliorati, V.; Guidoni, L. Hydration properties of the bromide aqua ion: the interplay of first principle and classical molecular dynamics, and X-ray absorption spectroscopy Inorg. Chem. 2010, 49, 4224-4231
78. Lamberti, C.; Bordiga, S.; Bonino, F.; Prestipino, C.; Berlier, G.; Capello, L.; D'Acapito, F.; Xamena, F. X. L. I.; Zecchina, A. Determination of the oxidation and coordination state of copper on different Cu-based catalysts by XANES spectroscopy in situ or in operando conditions Phys. Chem. Chem. Phys. 2003, 5, 4502-4509
79. Hammersley, A. P.; Svensson, S. O.; Hanfland, M.; Fitch, A. N.; Hausermann, D. Two-dimensional detector software: From real detector to idealised image or two-theta scan High Pressure Res. 1996, 14, 235-248
80. Roisnel, T.; Rodriquez-Carvajal, J. WinPLOTR: A Windows tool for powder diffraction pattern analysis Mater. Sci. Forum 2001, 378, 118-123
81. Ravel, B.; Newville, M. ATHENA, ARTEMIS, HEPHAESTUS: data analysis for X-ray absorption spectroscopy using IFEFFIT J. Synchrotron Radiat. 2005, 12, 537-541
82. Rehr, J. J.; Albers, R. C. Theoretical approaches to x-ray absorption fine structure Rev. Mod. Phys. 2000, 72, 621-654
83. Beni, G.; Platzman, P. Temperature and polarization dependence of extended X-ray absorption fine-structure spectra Phys. Rev. B 1976, 14, 1514-1518
84. Hedin, L.; Lundqvist, B. I. Explicit local exchange-correlation potentials J. Phys. C 1971, 4, 2064-2083
85. Rehr, J. J.; Ankudinov, A. L. Progress in the theory and interpretation of XANES Coord. Chem. Rev. 2005, 249, 131-140
86. Smolentsev, G.; Soldatov, A. Quantitative local structure refinement from XANES: multi-dimensional interpolation approach J. Synchrotron Radiat. 2005, 13, 19-29
87. Smolentsev, G.; Soldatov, A. V. FitIt: New software to extract structural information on the basis of XANES fitting Comput. Mater. Sci. 2007, 39, 569-574
88. Tew, M. W.; Janousch, M.; Huthwelker, T.; van Bokhoven, J. A. The roles of carbide and hydride in oxide-supported palladium nanoparticles for alkyne hydrogenation J. Catal. 2011, 283, 45-54
89. Tew, M. W.; Nachtegaal, M.; Janousch, M.; Huthwelker, T.; van Bokhoven, J. A. The irreversible formation of palladium carbide during hydrogenation of 1-pentyne over silica-supported palladium nanoparticles: in situ Pd K and L3 edge XAS Phys. Chem. Chem. Phys. 2012, 14, 5761-5768
90. Leontyev, I.; Guterman, V.; Pakhomova, E.; Timoshenko, P.; Guterman, A.; Zakharchenko, I.; Petin, G.; Dkhil, B. XRD and electrochemical investigation of particle size effects in platinum-cobalt cathode electrocatalysts for oxygen reduction J. Alloys Compd. 2010, 500, 241-246
91. Koningsberger, D.; Prins, R. X-ray Absorption: Principles, Applications, Techniques of EXAFS, SEXAFS and XANES; John Wiley & Sons: New York, 1987.
92. Pettifer, R. F.; Mathon, O.; Pascarelli, S.; Cooke, M. D.; Gibbs, M. R. Measurement of femtometre-scale atomic displacements by X-ray absorption spectroscopy Nature 2005, 435, 78-81
93. 1-xAs/InP strained epitaxial layers Phys. Rev. B 1998, 57, 14619-14622
94. Srabionyan, V. V.; Bugaev, A. L.; Pryadchenko, V. V.; Avakyan, L. A.; van Bokhoven, J. A.; Bugaev, L. A. EXAFS study of size dependence of atomic structure in palladium nanoparticles J. Phys. Chem. Solids 2014, 75, 470-476
95. Bugaev, A. L.; Srabionyan, V. V.; Soldatov, A. V.; Bugaev, L. A.; van Bokhoven, J. A. The role of hydrogen in formation of Pd XANES in Pd-nanoparticles J. Phys. Conf. Ser. 2013, 430, 012028-012033
96. Manchester, F. D.; San-Martin, A.; Pitre, J. M. The H-Pd (hydrogen-palladium) system J. Phase Equilib. 1994, 15, 62-83
97. Kishore, S.; Nelson, J.; Adair, J.; Eklund, P. Hydrogen storage in spherical and platelet palladium nanoparticles J. Alloys Compd. 2005, 389, 234-242
98. Hammersley, J. M.; Handscomb, D. C.; Weiss, G. Monte Carlo methods Phys. Today 1965, 18, 55