Jose Rodriguez’s Full Publication List: Over 450 publications; More than 33000 citations; H-index: 91. 1. "A Quantum-Chemical Study of the Active Sites for Cyclohexene Oxidation on CoY Zeolites", J.A. Rodriguez, E. Pietri, M.R. de Goldwasser, and A.J. Hernandez, Proceedings of the First French-Venezuelean Meeting of Catalysis, Universidad Central de Venezuela, Caracas, Venezuela, 1 (1983) 289-297. 2. "Quantum-Chemical Studies of the Effects of Electron-Transferring Ligands upon CO Chemisorption on Cu(100)",J.A. Rodriguez and C.T. Campbell, J. Phys. Chem., 91 (1987)2161- 2171. 3. "Quantum-Chemical Studies of Formate on Cu(100) and Cu(110)", J.A. Rodriguez and C.T. Campbell, Surf. Sci. 183 (1987) 449-468. 4. "Quantum-Chemical Studies of CN on Copper Surfaces", J.A. Rodriguez and C.T. Campbell, Surf. Sci., 185 (1987) 299-318. 5. "A Quantum-Chemical Study of ZnO, Cu/ZnO, Cu2O, and CuO Clusters and CO Chemisorption on ZnO(0001), CuZnO(0001), and Cu/ZnO(0001) Surfaces", J.A. Rodriguez and C.T. Campbell,J. Phys. Chem., 91 (1987) 6648-6658. 6. "A Quantum-Chemical Study of the Chemisorption of Ammonia, Pyridine, Formaldehyde, Formate and Methoxy on ZnO(0001)", J.A. Rodriguez and C.T. Campbell, Surf. Sci., 194 (1988) 475-504. 7. "A Quantum-Chemical Study of the Chemisorption of Water, Formaldehyde and Ammonia on Copper Surfaces and Water on ZnO(0001)", J.A. Rodriguez and C.T. Campbell, Surf. Sci., 197 (1988) 567-593. 8. "A New Method for Analysis of Reactive Adsorbed Intermediates: Bismuth Postdosing in Thermal Desorption Mass Spectroscopy", C.T. Campbell, J.A. Rodriguez, F.C. Henn, J.M. Campbell, P.J. Dalton and S.G. Seimanides, J. Chem. Phys., 88 (1988) 6585-6593. 9. "A Quantum-Chemical Study of the Adsorption of CO2 and OH on Cu and ZnO Surfaces and OH on Pt Surfaces", J.A. Rodriguez, Langmuir, 4 (1988) 1006-1020. 10. "Interactions of Simple Molecules on Copper, Platinum, Silver and Zinc-Oxide Surfaces", J.A.Rodriguez, PhD Thesis, Indiana University, November 1988 (Univ Microfilms Inc., Ann Arbor, Michigan 48106). 11. "Probing Ensemble Effects in Surface Reactions: I. Site-Size Requirements for the Dehydrogenation of Cyclic Hydrocarbons on Pt(111) Revealed by Bi Site Blocking", C.T. Campbell,
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Jose Rodriguez’s Full Publication List:
Over 450 publications; More than 33000 citations; H-index: 91.
1. "A Quantum-Chemical Study of the Active Sites for Cyclohexene Oxidation on CoY
Zeolites", J.A. Rodriguez, E. Pietri, M.R. de Goldwasser, and A.J. Hernandez, Proceedings of the
First French-Venezuelean Meeting of Catalysis, Universidad Central de Venezuela, Caracas,
Venezuela, 1 (1983) 289-297.
2. "Quantum-Chemical Studies of the Effects of Electron-Transferring Ligands upon CO
Chemisorption on Cu(100)",J.A. Rodriguez and C.T. Campbell, J. Phys. Chem., 91 (1987)2161-
2171.
3. "Quantum-Chemical Studies of Formate on Cu(100) and Cu(110)", J.A. Rodriguez and
C.T. Campbell, Surf. Sci. 183 (1987) 449-468.
4. "Quantum-Chemical Studies of CN on Copper Surfaces", J.A. Rodriguez and C.T.
Campbell, Surf. Sci., 185 (1987) 299-318.
5. "A Quantum-Chemical Study of ZnO, Cu/ZnO, Cu2O, and CuO Clusters and CO
Chemisorption on ZnO(0001), CuZnO(0001), and Cu/ZnO(0001) Surfaces", J.A. Rodriguez
and C.T. Campbell,J. Phys. Chem., 91 (1987) 6648-6658.
6. "A Quantum-Chemical Study of the Chemisorption of Ammonia, Pyridine,
Formaldehyde, Formate and Methoxy on ZnO(0001)", J.A. Rodriguez and C.T. Campbell,
Surf. Sci., 194 (1988) 475-504.
7. "A Quantum-Chemical Study of the Chemisorption of Water, Formaldehyde and
Ammonia on Copper Surfaces and Water on ZnO(0001)", J.A. Rodriguez and C.T. Campbell, Surf.
Sci., 197 (1988) 567-593.
8. "A New Method for Analysis of Reactive Adsorbed Intermediates: Bismuth
Postdosing in Thermal Desorption Mass Spectroscopy", C.T. Campbell, J.A. Rodriguez,
F.C. Henn, J.M. Campbell, P.J. Dalton and S.G. Seimanides, J. Chem. Phys., 88 (1988) 6585-6593.
9. "A Quantum-Chemical Study of the Adsorption of CO2 and OH on Cu and ZnO Surfaces
and OH on Pt Surfaces", J.A. Rodriguez, Langmuir, 4 (1988) 1006-1020.
10. "Interactions of Simple Molecules on Copper, Platinum, Silver and Zinc-Oxide
Surfaces", J.A.Rodriguez, PhD Thesis, Indiana University, November 1988 (Univ
Microfilms Inc., Ann Arbor, Michigan 48106).
11. "Probing Ensemble Effects in Surface Reactions: I. Site-Size Requirements for the
Dehydrogenation of Cyclic Hydrocarbons on Pt(111) Revealed by Bi Site Blocking", C.T. Campbell,
J.M. Campbell, P.J. Dalton, F.C. Henn, J.A. Rodriguez and S.G. Seimanides, J. Phys. Chem., 93
(1989) 806-814.
12. "Probing Ensemble Effects in Surface Reactions: III. Cyclohexane Adsorption
on Clean and Bismuth Covered Pt(111)", J.A. Rodriguez and C.T. Campbell, J. Phys. Chem., 93
(1989) 826-835.
13. "The Chemisorption of Ethylene Epoxide and Carbonate on Silver: A Quantum-
Chemical Study" J.A. Rodriguez and C.T. Campbell, Surf. Sci., 206 (1988) 426-450.
14. "Cyclohexene Adsorption and Reactions on Clean and Bismuth Covered Pt(111)",
J.A. Rodriguez and C.T. Campbell, J. Catalysis, 115 (1989) 500-520.
15. "A New Method for Analysis of Reactive Adsorbed Intermediates", C.T. Campbell,
J.A. Rodriguez, F.C. Henn and J.M. Campbell, J. Vac. Sci. Technol. A7 (1989) 2207-2208.
16. "Chemisorption Studies on Cs/Cu(110): Model Studies of Cesium Promoters
on Copper-Based Catalysts", J.A. Rodriguez, W.D. Clendening, J.M. Campbell, W. Min
and C.T. Campbell, J. Vac. Sci. Technol. A7 (1989) 2118-2120.
17. "Adsorption of CO and CO2 on Clean and Cesium-Covered Cu(110)", J.A.
Rodriguez, W.D. Clendening and C.T. Campbell, J. Phys. Chem., 93 (1989) 5238-5248.
18. "The Chemisorption and Coadsorption of Water and Oxygen on Cs-Dosed
Cu(110)", W.D. Clendening, J.A. Rodriguez, J.M. Campbell and C.T. Campbell, Surf. Sci.,
216 (1989) 429-461.
19. "The Adsorption of Methyl, Acetylide, Chlorine and Phosphorus Trifluoride on
Zinc Oxide: A Quantum-Chemical Study", J.A. Rodriguez, Surf. Sci., 222 (1989) 383-403.
20. "Does CO2 Dissociatively Adsorb on Cu Surfaces?", J. Nakamura, J.A.
Rodriguez, and C.T. Campbell, J. Phys.: Condens. Matter 1 (1989) SB149-SB160.
21. "The Adsorption of Nitric Oxide, Pyridine and Sulfur Dioxide on Silver: A
Quantum-Chemical Study", J.A. Rodriguez, Surf. Sci., 226 (1990) 101-118.
22. "The Adsorption of Nitrogen Dioxide, Nitrate and Sulfate on Ag(110): A
Quantum-Chemical Study", J.A. Rodriguez, Surf. Sci., 230 (1990) 335-349.
23. "Dissociative Adsorption and Hydrogenolysis of Ethane over Clean and Ni
Covered Pt(111)", J.A. Rodriguez and D.W. Goodman, J. Phys. Chem., 94 (1990) 5342-5347.
24. "The Adsorption of Pyrazine, Hydrogen Sulfide and Thiophene on Copper: A
Quantum Chemical Study", J.A. Rodriguez, Surf. Sci., 234 (1990) 421-438.
25. "Adsorption and Reaction of HCOOH on Doped Cu(110): Coadsorption with
Cesium, Oxygen, and Csa + Oa", F.C. Henn, J.A. Rodriguez and C.T. Campbell, Surf. Sci.,
236 (1990) 282-312.
26. "The Interaction of Ultrathin Films of Ni and Pd with W(110): An XPS Study" R.A.
Campbell, J.A. Rodriguez and D.W. Goodman, Surf. Sci., 240 (1990) 71-80.
27. "Electronic Interactions in Bimetallic Systems: An XPS Study", J.A. Rodriguez, R.A.
Campbell and D.W. Goodman, J. Phys. Chem., 94 (1990) 6936-6939.
28. "Catalytic Activation of CO over Single Crystals", J.A. Rodriguez and D.W.
Goodman, chapter III in: "New Trends in CO Activation", L. Guczi, editor (Elsevier,
Amsterdam,1991).
29. "The Interaction of Ultrathin Films of Cu with Rh(100) and Ru(0001): An XPS
Study", J.A. Rodriguez, R.A. Campbell and D.W. Goodman, J. Phys. Chem., 95 (1991) 2477-2483.
30. "The Adsorption of PF3, OH, SH and CH3 on Silver: A Quantum-Chemical Study",
J.A. Rodriguez, Langmuir, 7 (1991) 1206-1214.
31. "Adsorption of CO, H2, O2 and CO2 on Clean and Cu-covered Re(0001): An
XPS Study", J.A. Rodriguez, R.A. Campbell and D.W. Goodman, Surf. Sci., 244 (1991) 211-220.
32. "An X-Ray Photoelectron Spectroscopic Study of the Electronic Properties of
Ultra-Thin Ni Films on Ru(0001) and Mo(110)", R.A. Campbell, J.A. Rodriguez and D.W.
Goodman, Surf. Sci. 256 (1991) 272-280.
33. "Electronic Interactions in Bimetallic Systems: Core-Level Binding Energy Shifts",
J.A. Rodriguez, R.A. Campbell and D.W. Goodman, J. Vac. Sci. Technol. A, 9 (1991) 1698-1702.
34. "Surface Science Studies of the Electronic and Chemical Properties of Bimetallic
Systems", J.A. Rodriguez and D.W. Goodman, J. Phys. Chem., 95 (1991) 4196-4206 (invited).
35. "The Effects of CO, H, H2O, NH3, CH3OH and C2H4 on the Electronic Properties
of Ultrathin Cu Films Supported on Ru(0001): An XPS Study", J.A. Rodriguez, R.A. Campbell, J.S.
Corneille and D.W. Goodman, Chem. Phys. Lett., 180 (1991) 139-144.
36. "High-Pressure Catalytic Reactions over Single-Crystal Metal Surfaces",
J.A. Rodriguez and D.W. Goodman, Surf. Sci. Reports 14 (1991) 1-108 (invited).
37. "Electron Donor-Electron Acceptor Interactions in Bimetallic Surfaces: Theory and
XPS Studies" J.A. Rodriguez, R.A. Campbell and D.W. Goodman, J. Phys. Chem., 95 (1991) 5716-
5719.
38. "Molecular Precursors to Boron Nitride Thin Films: I. Adsorption of Diborane
on Ru(0001), NH3/Ru(0001) and O/Ru(0001) Surfaces", J.A. Rodriguez, C.M. Truong,
J.S. Corneille and D.W. Goodman, J. Phys. Chem., 96 (1992) 334-341.
39. "The Chemical and Electronic Properties of Ultrathin Metal Films: the Pd/Re(0001)
and Pd/Ru(0001) Systems", R.A. Campbell, J.A. Rodriguez, and D.W. Goodman, Phys.
Rev. B, 46 (1992) 7077-7087.
40. "Molecular Precursors to Boron Nitride Thin Films: II.Coadsorption and Reaction
Diborane and Hydrazine on Ru(0001)", C.M. Truong, J.A.Rodriguez, and D.W. Goodman,
J. Phys. Chem., 96 (1992) 341-347.
41. "Electronic and Chemical Interactions between Boron and Carbon Monoxide
on Ru(0001): A TDS, XPS and FT-IRAS Study", J.A. Rodriguez, C.M. Truong, W.K. Kuhn
and D.W. Goodman, J. Chem. Phys., 96 (1992) 740-747.
42. "Electron Donor - Electron Acceptor Interactions in Surface Metal-Metal Bonds:
the Cu/Re(0001) and Pd/Re(0001) Systems", J.A. Rodriguez, R.A. Campbell and D.W. Goodman, J.
Vac. Sci. Technol. A, 10 (1992) 2540-2545.
43. "Synthesis of Boron Nitride Ultrathin Films: The Bonding and Chemistry of Ammonia
and Hydrazine on Ru(0001) and B/Ru(0001) Surfaces", J.A. Rodriguez, C.M. Truong and
D.W. Goodman, J. Vac. Sci. Technol. A, 10 (1992) 955-959.
44. "FT-IRAS Studies of Ammonia on Ru(0001)", J.A. Rodriguez, W.K. Kuhn, C.M.
Truong and D.W. Goodman, Surf. Sci., 271 (1992) 333-339.
45. "Infrared Vibrational Studies of CO Adsorption on Cu/Pt(111) and CuPt(111)
Surfaces", J.A. Rodriguez, C.M. Truong and D.W. Goodman, J. Chem. Phys., 96 (1992)
7814-7825.
46. "The Bonding of Acetate, Methoxy, Thiomethoxy and Pyridine to Cu surfaces:
A Molecular Orbital Study" J.A. Rodriguez, Surf. Sci., 273 (1992) 385-404.
47. "FT-IRAS Studies of CO Adsorbed on Ag/Pt(111): Anomalous Behavior of
Vibrational Cross-Sections" J.A. Rodriguez, C.M. Truong and D.W. Goodman, Surf. Sci.,
271 (1992) L331-L337.
48. "CO Adsorption Isotherms on Cu(100) at Elevated Pressures and Temperatures
using Infrared Reflection Absorption Spectroscopy" C.M. Truong, J.A. Rodriguez and
D.W. Goodman, Surf. Sci., 271 (1992) L385-L391.
49. "The Nature of the Metal-Metal Bond in Bimetallic Surfaces" J.A. Rodriguez and
D.W. Goodman, Science, 257 (1992) 897-903 (invited).
50. "Metal-Metal Bonding on Surfaces: Zn-Au on Ru(001)" J.A. Rodriguez and J.
Hrbek, J. Chem. Phys., 97 (1992) 9427-9439.
51. "Bonding and Decomposition of Thiophene, Sulfhydryl, Thiomethoxy and
Phenyl Thiolate on Mo Surfaces" J.A. Rodriguez, Surf. Sci., 278 (1992) 326-338.
52. "Electronic and Chemical Properties of Li-Au and Cs-Au Films on Ru(001)" J.A.
Rodriguez, J. Hrbek, M. Kuhn and T.K. Sham, J. Vac. Sci. Technol. A, 11 (1993) 2029-2033.
53. "Photoemission Studies of Zinc-Noble Metal Alloys: Zn-Cu, Zn-Ag and Zn-Au Films on
Ru(001)" J.A. Rodriguez and J. Hrbek, J. Vac. Sci. Technol. A, 11 (1993) 1998-2002.
54. "The Chemical Properties of Bimetallic Surfaces: Bonding between CO and Zn on
Ru(001)", J.A. Rodriguez, Surf. Sci. 289 (1993) L584-L590.
55. "The Interaction of O2 with Li-Au and Cs-Au Films: A Photoemission and Thermal
Desorption Study" J.A. Rodriguez, J. Hrbek, M. Kuhn and T.K. Sham, J. Phys. Chem. 97 (1993)
4737-4744.
56. "The Chemical Properties of Bimetallic Surfaces: The Reaction of O2 and NO2 with Zn
on Ru(001)" J.A. Rodriguez, J. Phys. Chem. 97 (1993) 6509-6517.
57. "Metal-Metal Bonds in Bimetallic Surfaces", J.A. Rodriguez and D.W. Goodman,
Science 260 (1993) 1527-1528.
58. "Photoemission and Thermal Desorption Studies of Cs-Au and Li-Au Films on Ru(001)"
J.A. Rodriguez, J. Hrbek, Y.W. Yang, M. Kuhn and T.K. Sham, Surf. Sci. 293 (1993) 260-274.
59. "Metal-Metal Bonding on Surfaces: Electronic and Chemical Properties of Ag on
Ru(001)" J.A. Rodriguez, Surf. Sci. 296 (1993) 149-163.
60. "Oxidation of Cesium Multilayers", J. Hrbek, Y.W. Yang and J.A. Rodriguez, Surf. Sci.
296 (1993) 164-170.
61. "Metal-Metal Bonding on Surfaces: Molecular Orbital Study of Pd/Ti(001) and
Pd/Ru(001)" J.A. Rodriguez, Surf. Sci. 303 (1994) 366-376.
62. "Electronic and Chemical Properties of Silver-Lithium Alloy Films: The Ag-Li, O2/Ag-Li
and CO/Ag-Li Systems" J.A. Rodriguez and J. Hrbek, J. Phys. Chem. 98 (1994) 4061-4068.
63. "Synergistic Interactions in Three-Center Metal-Metal Bonding: Cu-Zn on Ru(001)" J.A.
Rodriguez and J. Hrbek, Chem. Phys. Lett., 220 (1994) 486-492.
64. "The Nature of Metal-Metal Bonding at Bimetallic Interfaces" J.A. Rodriguez, R.A.
Campbell and D.W. Goodman, Surf. Sci., 307-309 (1994) 377-383 (invited).
65. "Decomposition of NO2 on Metal Surfaces: Oxidation of Ag, Zn and Cu Films" J.A.
Rodriguez and J. Hrbek, J. Vac. Sci. Technol. A, 12 (1994) 2140-2144.
66. "Chemical Properties of Zn on Ru(001): Coadsorption with Cs, O, Cu and Au" J.A.
Rodriguez and J. Hrbek, J. Vac. Sci. Technol. A, 12 (1994) 2153-2158.
67. "Synergistic Interactions in Trimetallic Bonding: A Comparison of the ZnNM/Ru(001)
(NM= Cu, Ag or Au) Systems" J.A. Rodriguez and J. Hrbek, Surf. Sci., 312 (1994) 345-360.
68. "Cesium-Catalyzed Oxidation of Zinc Surfaces" J.A. Rodriguez and J. Hrbek, Catal.
Lett. 26 (1994) 393-399.
69. "Interactions in Bimetallic Bonding: Electronic and Chemical Properties of PdZn
Surfaces" J.A. Rodriguez, J. Phys. Chem., 98 (1994) 5758-5764.
70. "Chemical Properties of Bimetallic Surfaces: Repulsive Interactions between Zn and S on
Ru(001)" M. Kuhn, J.A. Rodriguez and J. Hrbek, Surf. Sci. 314 (1994) L897-L903.
71. "Electronic Interactions in Bimetallic Bonding: Molecular Orbital Study of Pd/Al(111)
and Au/Al(111)" J.A. Rodriguez, Surf. Sci. 318 (1994) 253-261.
72. "Electronic and Chemical Properties of Ag/Pt(111) and Cu/Pt(111) Surfaces: Importance
of Changes in the d Electron Populations", J.A. Rodriguez and M. Kuhn, J. Phys. Chem., 98 (1994)
11251-11255.
73. "Interaction of Sulfur with Bimetallic Surfaces: Coadsorption of Sulfur and Noble Metals
on Ru(001)", M. Kuhn and J.A. Rodriguez, J. Phys. Chem., 98 (1994) 12059-12066.
74. "Repulsive Interactions between Sulfur and Gold on Ru(0001)" M. Kuhn and J.A.
Rodriguez, Chem. Phys. Lett. 231 (1994) 199-205.
75. "The Interaction of Sulfur with Ag/Pt(111) Surfaces: Silver-Promoted Sulfidation of
Platinum" M. Kuhn and J.A. Rodriguez, J. Catal. 154 (1995) 355-363.
76. "Electronic Properties of Pt in Bimetallic Systems: Photoemission and Molecular Orbital
Studies for Pt-Al Surface Alloys", J.A. Rodriguez and M. Kuhn, Chem. Phys. Lett.
240 (1995) 435-441.
77. "Adsorption of Sulfur on Bimetallic Surfaces: Formation of Copper Sulfides on Pt(111)
and Ru(001)" M. Kuhn and J.A. Rodriguez, J. Vac. Sci. Technol. A, 13 (1995) 1569-1573.
78. "Chemical and Electronic Properties of Pt in Bimetallic Surfaces: Photoemission and
CO-Chemisorption Studies for Zn/Pt(111)" J.A. Rodriguez and M. Kuhn, J. Chem. Phys.
105 (1995) 4279-4289.
79. "The Interaction of Sulfur with Cu/Pt(111) and Zn/Pt(111) Surfaces: Copper-Promoted
Sulfidation of Platinum", M. Kuhn and J.A. Rodriguez, Catal. Lett. 32 (1995) 345-355.
80. "Electronic Properties of Gold on Mo(110): ds,p Charge Redistribution and Valence
Band Shifts", J.A. Rodriguez and M. Kuhn, Surf. Sci. 330 (1995) L657-L664.
81. "Coadsorption of Zn and S on Mo(110): Weakening of the Zn-Mo Bond and Zn-
Promoted Sulfidation of Mo", M. Kuhn and J.A. Rodriguez, Surf. Sci. 336 (1995) 1.
82. "Reaction of S2 with NM/Mo(110) (NM= Cu or Ag) Surfaces: Poisoning of Bimetallic
Bonding and Noble-Metal Promoted Sulfidation of Mo" J.A. Rodriguez and M. Kuhn, J. Phys.
Chem. 99 (1995) 9567-9575.
83. "Adsorption of Au on Ru(001): Electronic Perturbations and the Nature of the Bimetallic
Bond" M. Kuhn, J.A. Rodriguez, J. Hrbek, A. Bzowski and T.K. Sham, Surf. Sci. 341 (1995) L1011-
L1018.
84. "Chemical and Electronic Properties of Bimetallic Surfaces" J.A. Rodriguez and D.W.
Goodman, Acc. Chem. Res. 28 (1995) 477-478.
85. "Interaction of Zinc with Transition-Metal Surfaces: Electronic and Chemical
Perturbations induced by Bimetallic Bonding" J.A. Rodriguez and M. Kuhn, J. Phys. Chem. 100
(1996) 381-389.
86. "Repulsive Interactions between Au and S on Mo(110) and Rh(111): An Experimental
and Theoretical Study", J.A.Rodriguez, M. Kuhn and J. Hrbek, J. Phys. Chem. 100 (1996) 3799-
3808.
87. "Electronic and Chemical Properties of Pt, Pd and Ni in Bimetallic Surfaces", J.A.
Rodriguez, Surf. Sci. 345 (1996) 347-362.
88. "Photoemission Studies of S/Co/Mo(110) and S/Ni/Mo(110) Surfaces: Co- and Ni-
Promoted Sulfidation of Mo(110)", J.A. Rodriguez and M. Kuhn, Surf. Sci. 355 (1996) 85-99.
89. "Electronic Properties of Bimetallic Surfaces", J.A. Rodriguez, Heterogeneous Chemistry
Reviews, 3 (1996) 17-32 (invited).
90. "The Bonding of Sulfur to a Pt(111) Surface: Photoemission and Molecular-Orbital
Studies", J.A. Rodriguez, M. Kuhn and J. Hrbek, Chem. Phys. Lett. 251 (1996) 13-19.
91. "Interaction of Sulfur and Bimetallic Surfaces: Fe-Promoted Sulfidation of
Mo(110)", J.A. Rodriguez and M. Kuhn, J. Vac. Sci. Technol. A, 14 (1996) 1609-1613.
92. "Ru-Promoted Alloying of Au and Cu Films: Photoemission Studies", M. Kuhn, A.
Bzowski, T.K. Sham, J.A. Rodriguez and J. Hrbek, Thin Solid Films, 283 (1996) 209-220.
93. "Coadsorption and Reaction of Sulfur and Silver on a Ru(001) Surface", J. Hrbek, M.
Kuhn and J.A. Rodriguez, Surf. Sci., 356 (1996) L423-L428.
94. "The Interaction of Sulfur with Au/Pt(111) and Ag/Pt(111) Surfaces: Photoemission
Studies", J.A. Rodriguez, M. Kuhn and J. Hrbek, J. Phys. Chem. 100 (1996) 15494-15502.
95. "Physical and Chemical Properties of Bimetallic Surfaces", Surf. Sci. Reports, 24 (1996)
223-287 (invited).
96. "Reaction of S2 with X/Mo(110) (X= Fe, Pt or Al) Surfaces: Admetal-Promoted
Sulfidation of Mo and the Behavior of Hydrodesulfurization Catalysts", M. Kuhn, J.A. Rodriguez
and J. Hrbek, Surf. Sci. 365 (1996) 53-68.
97. "Reaction of Hydrogen with S/Mo(110) and MoSx Films: Formation of Hydrogen
Sulfide", S.Y. Li, J.A. Rodriguez, J. Hrbek, H.H. Huang and G.-Q. Xu, Surf. Sci. 366 (1996) 29-42.
98. "Chemical Properties of Zn/S/Mo(110) and Co/S/Mo(110) Surfaces: Reaction with
Hydrogen and Formation of Hydrogen Sulfide", J.A. Rodriguez, S.Y. Li, J. Hrbek, H.H. Huang and
G.-Q. Xu, J. Phys. Chem. 100 (1996) 14476-14484.
99. "Electronic and Chemical Properties of Pd in Bimetallic Systems: Interaction of Pd with
Rh(111)", J.A. Rodriguez and M. Kuhn, Surf. Sci. 365 (1996) L669-L675.
100. "The Interaction of Ni and Fe with Sulfur and Molybdenum-Sulfide Surfaces: a TDS,
XPS and Hydrogen-Chemisorption Study", J.A. Rodriguez, S.Y. Li, J. Hrbek, H.H. Huang and G.-Q.
Xu, Surf. Sci. 370 (1996) 85-100.
101. "The Interaction of Silver, Cesium and Zinc with Alumina Surfaces: Thermal-
Desorption and Photoemission Studies", J.A. Rodriguez, M. Kuhn and J. Hrbek, J. Phys. Chem., 100
(1996) 18240-18248.
102. "Synthesis of Sulfur Films from S2 Gas: Spectroscopic Evidence for the Formation of Sn
Species", J. Hrbek, S.Y. Li, J.A. Rodriguez, H.H. Huang and G.-Q. Xu, Chem. Phys. Lett. 267
(1997) 65-71.
103. "Properties of Fe, Co, Ni, Cu and Zn on S/Mo(110) Surfaces and MoSx Films: Metal-
Metal Interactions and the Behavior of HDS Catalysts", J.A. Rodriguez, Polyhedron, 16 (1997)
3177-3184 (invited).
104. "The Interaction of Cu and S2 with Aluminum and Alumina Surfaces: A Comparative
Study", J.A. Rodriguez, M. Kuhn and J. Hrbek, Surf. Sci. 380 (1997) 397-407.
105. "Interactions between Sulfur and Platinum in Bimetallic Surfaces: Reaction of S2 with
Pt-Al Alloys", J.A. Rodriguez and M. Kuhn, J. Vac. Sci. Technol. A, 15 (1997) 1608-1612.
106. "Thermal Stability of Ultrathin Cr Films on Pt(111)", L. Zhang, M. Kuhn, U. Diebold
and J.A. Rodriguez, J. Phys. Chem. B, 101 (1997) 4588-4596.
107. "The Reaction of Hydrogen with O/Ru(001) and RuOx Films: Formation of Hydroxyl
and Water", S.Y. Li, J.A. Rodriguez, J. Hrbek, H.H. Huang and G.-Q. Xu, J. Vac. Sci. Technol.
A, 15 (1997) 1692-1697.
108. "The Adsorption of Sulfur on Ag/Al2O3 and Zn/Al2O3 Surfaces: Thermal Desorption,
Photoemission and Molecular Orbital Studies", J.A. Rodriguez and M. Kuhn, J. Phys. Chem. B, 101
(1997) 3187-3195.
109. "Cesium Promoted Oxidation of Zinc and Copper-Zinc Surfaces: A Combined
Experimental and Theoretical Study", S. Chaturvedi, J.A. Rodriguez and J. Hrbek, Surf. Sci. 384
(1997) 260-275.
110. "Chemical and Electronic Properties of Silver Atoms Supported on Sulfur and
Molybdenum Sulfide Surfaces", S.Y. Li, J.A. Rodriguez, J. Hrbek, H.H. Huang and G.-Q. Xu, Surf.
Sci. 395 (1998) 216-228.
111. "Interaction of Hydrogen and Thiophene with Ni/MoS2 and Zn/MoS2 Surfaces: A
Molecular Orbital Study", J.A. Rodriguez, J. Phys. Chem. B, 101 (1997) 7524-7534.
112. "H2S Adsorption on Chromium, Chromia and Gold/Chromia Surfaces:Photoemission
Studies", J.A. Rodriguez, S Chaturvedi , M.Kuhn, J. van Ek, U. Diebold, P.S. Robbert, H. Geisler
and C.A. Ventrice, J. Chem. Phys. 107 (1997) 9146-9156.
113. "Electronic Properties and Phase Transformations in CoMoO4 and NiMoO4: XANES
and Time-Resolved Synchrotron XRD Studies", J.A. Rodriguez, S. Chaturvedi, J.C. Hanson, A.
Albornoz and J.L. Brito, J. Phys. Chem. B, 102 (1998) 1347-1355.
114. "Reaction of S2 with ZnO and Cu/ZnO Surfaces: Photoemission and Molecular Orbital
Studies", S. Chaturvedi, J.A. Rodriguez and J. Hrbek, J. Phys. Chem. B, 101 (1997) 10860-10869.
115. "Interactions between Cs and Noble Metals (Cu, Ag and Au) on ZnO Surfaces:
Electronic Perturbations and Alloy Formation", S. Chaturvedi and J.A. Rodriguez, Surf. Sci.401
(1998) 282-295.
116. "The Adsorption of Sulfur on Rh(111) and Cu/Rh(111) Surfaces", J.A. Rodriguez, S.
Chaturvedi and M. Kuhn, J. Chem. Phys. 108 (1998) 3064-3073.
117. "Characterization of Pure and Sulfided NiMoO4 Catalysts using Synchrotron-based X-
ray Absoption Spectroscopy (XAS) and Temperature Programmed Reduction (TPR)", S. Chaturvedi,
J.A. Rodriguez and J.L. Brito, Catal. Lett. 51 (1998) 85-98.
118. "The Interaction of H2S and S2 with Metal/Oxide Surfaces: Correlation Between Band-
Gap Size and Reactivity", J.A. Rodriguez, S. Chaturvedi, M. Kuhn and J. Hrbek, J. Phys. Chem. B,
102 (1998) 5511-5519.
119. “Novel Electronic and Magnetic Properties of Ultra-Thin Chromium Oxide Films
Grown on Pt(111)”, P.S. Robbert, H. Geisler, C.A. Ventrice, J. van Ek, S. Chaturvedi, J.A.
Rodriguez, M. Kuhn and U. Diebold, J. Vac. Sci. Technol. A, 16 (1998)990-995.
120. “The Interaction of H2S and S2 with Cs and Cs/ZnO Surfaces: Photoemission and
Molecular-Orbital Studies”, J.A. Rodriguez, T. Jirsak, S. Chaturvedi and J. Hrbek, Surf. Sci. 407
(1998) 171-188.
121. “Properties of Pure and Sulfided NiMoO4 and CoMoO4 Catalysts: TPR, XANES and
Time-Resolved XRD Studies”, S. Chaturvedi, J.A. Rodriguez, J.C. Hanson, A. Albornoz and J.L.
Brito, Proceedings of Symposium on Advanced Catalytic Materials, Materials Research Society: Fall
1997 Meeting, Vol 497, p. 41.
122. “Ag Promoted Sulfidation of Metal and Oxide Surfaces: A Photoemission Study of the
Interaction of Sulfur with Ag/Rh(111) and Ag/ZnO”, S. Chaturvedi, J.A. Rodriguez,
T. Jirsak and J. Hrbek, Surf. Sci. 412/413 (1998) 273-286.
123. “Reaction of S2 and H2S with Sn/Pt(111) Surface Alloys: Effects of Metal-Metal
Bonding on Reactivity towards Sulfur”, J.A. Rodriguez, S. Chaturvedi, T. Jirsak and J. Hrbek, J.
Chem. Phys. 109 (1998) 4052-4062.
124. “Chemistry of SO2 on Ru(001): Formation of SO3 and SO4", T. Jirsak, J.A. Rodriguez,
S. Chaturvedi and J. Hrbek, Surf. Sci. 418 (1998) 8-21.
125. “Surface Chemistry of SO2 on Zn and ZnO: Photoemission and Molecular Orbital
Studies”, S. Chaturvedi, J.A. Rodriguez, T. Jirsak and J. Hrbek, J. Phys. Chem. B,102 (1998) 7033-
7043.
126. “A comparison of the Reaction of S2 with Cu, Cu2O and Cu/ZnO: Electronic Properties
and Reactivity of Copper”, J.A. Rodriguez, S. Chaturvedi and M. Kuhn, Surf. Sci. 415 (1998)
L1065-L1073.
127. “Surface Chemistry of SO2 on Sn and Sn/Pt(111) Alloys Effects of Metal-Metal
Bonding on Reactivity towards Sulfur”, J.A. Rodriguez, T. Jirsak, S. Chaturvedi and J. Hrbek,
J. Am. Chem. Soc. 120 (1998) 11149-11157.
128. “Reaction of H2 and H2S with CoMoO4 and NiMoO4: TPR, XANES, Time-Resolved
XRD, and Molecular-Orbital Studies”, J.A. Rodriguez, S. Chaturvedi, J. Hanson and J.L. Brito, J.
Phys. Chem. B, 103 (1999) 770-781.
129. “Bonding of Sulfur to Pd Surfaces: Photoemission and Molecular-Orbital Studies”,
J.A. Rodriguez, S. Chaturvedi, and T. Jirsak, Chem. Phys. Lett.296 (1998) 421-428.
130. “Chemistry of SO2 on Mo(110), MoO2/Mo(110) and Cs/Mo(110) Surfaces: Effects
of O and Cs on the Formation of SO3 and SO4 Species”, T. Jirsak, J.A. Rodriguez and J. Hrbek, Surf.
Sci. 426 (1999) 319-335.
131. “Reaction of S2 and SO2 with Pd/Rh(111) Surfaces: Effects of Metal-Metal Bonding
on Sulfur Poisoning”, J.A. Rodriguez, T. Jirsak and S. Chaturvedi, J. Chem. Phys. 110 (1999) 3138-
3148.
132. “Adsorption of Thiophene on Surfaces of Clean and Ni-promoted Molybdenum
Sulfide”, J.A. Rodriguez, J. Dvorak, A.T. Capitano, A.M. Gabelnick and J.L. Gland, Surf. Sci. 429
(1999) L462-L468.
133. “Reaction of SO2 with Cesium and Cesium-promoted ZnO and MoO2", J.A.
Rodriguez, T. Jirsak and J. Hrbek, J. Phys. Chem. B, 103 (1999) 1966-1976.
134. “Chemistry of Thiophene on ZnO, S/ZnO and Cs/ZnO Surfaces: Effects of Cesium on
Desulfurization Processes”, T. Jirsak, J. Dvorak and J.A. Rodriguez, J. Phys. Chem. B, 103 (1999)
5550.
135. “Electronic Structure of Au-Ag bimetallics: Surface Alloying on Ru(001)”, A.
Bzowski, M. Kuhn, T.K. Sham, J.A. Rodriguez, and J. Hrbek, Phys. Rev. B, 59 (1999) 13379-
13393.
136. “Adsorption of NO2 on Rh(111) and Pd/Rh(111): Photoemission Studies”, T. Jirsak,
J. Dvorak and J.A. Rodriguez, Surf. Sci. 436 (1999) L683-L690.
137. “Interaction of Sulfur with Well-Defined Metal and Oxide Surfaces: Unraveling the
Mysteries behind Catalyst Poisoning and Desulfurization”, J.A. Rodriguez and J. Hrbek, Accounts of
Chemical Research, 32 (1999) 719-728 (invited).
138. “Chemistry of Thiophene, Pyridine and Cyclohexylamine on Ni/MoSx and
Ni/S/Mo(110) Surfaces: Role of Nickel in Hydrodesulfurization and Hydrodenitrogenation
Processes”, J.A. Rodriguez, J. Dvorak, T. Jirsak, S.Y. Li, J. Hrbek, A.T. Capitano, A.M. Gabelnick
and J.L. Gland, J. Phys. Chem. B, 103 (1999) 8310-8318.
139. “Reaction of H2S with MgO(100) and Cu/MgO(100) Surfaces: Band-Gap Size and
Chemical Reactivity”, J.A. Rodriguez, T. Jirsak and S. Chaturvedi, J. Chem. Phys. 111 (1999)
8077-8087.
140. “Interaction of SO2 with CeO2 and Cu/CeO2 Catalysts: Photoemission, XANES and
TPD Studies”, J.A. Rodriguez, T. Jirsak, A. Freitag, J.C. Hanson, J.Z. Larese and
S. Chaturvedi, Catalysis Letters, 62 (1999) 113-119.
141. “A Prelude to Surface Chemical Reaction: Visualization of the Induction Period of
Sulfur Interaction with a Strained Cu Layer”, J. Hrbek, J. de la Figuera, K. Pohl, T. Jirsak,
J.A. Rodriguez, A.K. Schmid, N.C. Bartelt and R.Q. Hwang, J. Phys. Chem. B,103 (1999) 10557-
10561.
142. “Reaction of SO2 with ZnO(000ī)-O and ZnO Powders: Photoemission and XANES
Studies on the Formation of SO3 and SO4", J.A. Rodriguez, T. Jirsak, S. Chaturvedi, and M. Kuhn,
Surf. Sci. 442 (1999) 400-412.
143. “Phase Transitions and Electronic Properties in Mixed-Metal Oxides: Experimental
and Theoretical Studies on the Behavior of NiMoO4 and MgMoO4", J.A. Rodriguez, J.C. Hanson, S.
Chaturvedi, A. Maiti and J.L. Brito, J. Chem. Phys. 112 (2000) 935-945.
144. “Chemistry of SO2 on Model Metal and Oxide Catalysts: Photoemission and XANES
Studies”, J.A. Rodriguez, T. Jirsak, S. Chaturvedi, J. Hrbek, A. Freitag and J.Z. Larese, Studies in
Surface Science and Catalysis, 130 (2000) 3177-3182.
145. “Characterization of Oxide Catalysts using Time-Resolved XRD and XANES:
Properties of Pure and Sulfided CoMoO4 and NiMoO4", J.A. Rodriguez, J.C. Hanson, S. Chaturvedi
and J.L. Brito, Studies in Surface Science and Catalysis,130 (2000) 2795-2800.
146. “Reaction of NO2 with Zn and ZnO: Photoemission, XANES and Density Functional
Studies on the Formation of NO3", J.A. Rodriguez, T. Jirsak, J. Dvorak, S. Sambasivan and D.
Fischer, J. Phys. Chem. B,104 (2000) 319-328 .
147. “Chemistry of NO2 on Mo(110): Descomposition Reactions and Formation of MoO2",
T. Jirsak, M. Kuhn and J.A. Rodriguez, Surf. Sci. 457 (2000) 254-266.
148. “Chemistry of Thiophene on Mo(110), MoCx and MoSx Surfaces: Photoemission
Studies”, J.A. Rodriguez, J. Dvorak and T. Jirsak, Surf. Sci. 457 (2000) L413-L420.
149. “Adsorption and Decomposition of H2S on MgO(100), NiMgO(100), and ZnO(0001)
Surfaces: A First-Principles Density Functional Study”, J.A. Rodriguez and A. Maiti, J. Phys. Chem.
B, 104 (2000) 3630-3638.
150. “Experimental Investigations on the Interaction of SO2 with MgO”, A. Freitag, J.A.
Rodriguez and J.Z. Larese, Symposium on Applications of Synchrotron Radiation Techniques to
Materials Science, MRS Symposium Proceedings, 590 (2000) 189-194.
151. “Characterization of Mixed-Metal Oxides using Synchrotron-Based Time-Resolved X-
ray Diffraction and X-ray Absorption Spectroscopy”, J.A. Rodriguez, J.C. Hanson, J.L. Brito and A.
Maiti, Symposium on Applications of Synchrotron Radiation Techniques to Materials Science, MRS
Symposium Proceedings, 590 (2000) 113-118.
152. “Chemistry of NO2 on CeO2 and MgO: Experimental and Theoretical Studies on the
Formation of NO3", J.A. Rodriguez, T. Jirsak, S. Sambasivan, D. Fischer and A. Maiti, J. Chem.
Phys. 112 (2000) 9929-9938.
153. “Interaction of SO2 with MgO(100) and Cu/MgO(100): Decomposition Reactions and
the Formation of SO3 and SO4", J.A. Rodriguez, T. Jirsak, A. Freitag, J.Z. Larese, and A. Maiti, J.
Phys. Chem. B, 104 (2000) 7439-7448.
154. “Studies on the Behavior of Mixed-Metal Oxides: Structural, Electronic and Chemical
Properties of β-FeMoO4", J.A. Rodriguez, J.C. Hanson, S. Chaturvedi, A. Maiti, and J.L. Brito, J.
Phys. Chem. B, 104 (2000) 8145-8152.
155. “Interaction of Sulfur with Pt(111) and Sn/Pt(111): Effects of Coverage and Metal-
Metal Bonding on Reactivity towards Sulfur”, J.A. Rodriguez, J. Hrbek, M. Kuhn, T. Jirsak, S.
Chaturvedi, and A. Maiti, J. Chem. Phys. 113 (2000) 11284-11292.
156. “Chemistry of SO2, H2S, and CH3SH on Carbide-Modified Mo(110) and Mo2C
powders: Photoemission and XANES Studies”, J.A. Rodriguez, J. Dvorak and T. Jirsak, J. Phys.
Chem. B, 104 (2000) 11515.
157. “Interaction of NO and NO2 with MgO(100): Photoemission and Density Functional
Studies”, J.A. Rodriguez, T. Jirsak, J.-Y. Kim, J.Z. Larese and A. Maiti, Chem. Phys. Lett. 330
(2000) 475-483.
158. “Chemistry of SO2 and NO2 on ZnO(0001)-Zn and ZnO Powders: Changes in
Reactivity with Surface Structure and Composition”, J.A. Rodriguez, T. Jirsak, S. Chaturvedi and J.
Dvorak, J. Molec. Catal. A, 167 (2001) 47-57.
159. “Studies on the Behavior of Mixed-Metal Oxides and Desulfurization: Reaction of H2S
and SO2 with Cr2O3(0001), MgO(100) and CrxMg1-xO(100)”, J.A. Rodriguez, T. Jirsak,
M. Perez, S. Chaturvedi, M. Kuhn, L. Gonzalez, and A. Maiti, J. Am. Chem. Soc. 122 (2000) 12362-
12370.
160. “Chemistry of NO2 and SO2 on ice layers and H2O/Zn Interfaces: Photoemission
Studies on the Formation of Acid Water and Metal Corrosion”, T. Jirsak and J.A. Rodriguez,
Langmuir, 16 (2000) 10287-10293.
161. “Studies on the Behavior of Mixed-Metal Oxides: Adsorption of CO and NO on
MgO(100), NixMg1-xO(100) and CrxMg1-xO(100)”, J.A. Rodriguez, M. Perez, L. Gonzalez, T. Jirsak
and A. Maiti, J. Chem. Phys. 114 (2001) 4186-4195.
162. “High Resolution Photoemission Studies of Sulfur Interaction with Model Catalytic
Surfaces”, J. Hrbek, J.A. Rodriguez, T. Jirsak, and J. Dvorak, J. Electron Spectroscopy and Related
Phenomena, 119 (2001) 201-206.
163. “Coadsorption of Sodium and SO2 on MgO(100): Alkali Promoted S-O Bond
Cleavage”, J.A. Rodriguez, M. Perez, T. Jirsak, L. Gonzalez and A. Maiti, Surf. Sci. 477 (2001)
L279-L288.
164. “DeNOx Reactions on MgO(100), ZnxMg1-xO(100), CrxMg1-xO(100), and
Cr2O3(0001): Correlation between Electronic and Chemical Properties of Mixed-Metal Oxides”,
J.A. Rodriguez, M. Perez, T. Jirsak, L. Gonzalez, A. Maiti and J.Z. Larese, J. Phys. Chem. B, 105
(2001) 5497-5005.
165. “Environmental Catalysis and the Chemistry of SO2 on Oxide Surfaces:
Fundamental Principles for the Cleavage of S-O Bonds@, J.A. Rodriguez, Ciencia, 9 (2001) 139-
154 (invited).
166. “Electronic and Chemical Properties of Ce0.8Zr0.2O2(111) Surfaces: Photoemission,
XANES, Density Functional, and NO2 Adsorption Studies”, G. Liu, J.A. Rodriguez, J. Hrbek, J.
Dvorak, and C.H.F. Peden, J. Phys. Chem. B, 105 (2001) 7762-7770.
167. “Interaction of Sulfur with TiO2(110): Photoemission and Density-Functional
Studies”, J.A. Rodriguez, J. Hrbek, J. Dvorak, T. Jirsak and A. Maiti, Chem. Phys. Lett. 336
(2001) 377-384.
168. “Fundamental Studies of Desulfurization Processes: Reaction of Methanethiol
on ZnO and Cs/Zn”, J. Dvorak, T. Jirsak, and J.A. Rodriguez, Surf. Sci. 479 (2001) 155.
169. “Electronic and Chemical Properties of Palladium in Bimetallic Systems:
How Much Do We Know About Heteronuclear Metal-Metal Bonding?” J.A. Rodriguez,
Chapter for : “The Chemical Physics of Solid Surfaces and Heterogenoeus Catalysis”, Vol. 10,
chapter 12, Elsevier, Amsterdam, (2002). (invited).
170. “Density Functional Studies of the Adsorption and Decomposition of SO2
on Cu(100)”, J.A. Rodriguez, J.M. Ricart, A, Clotet, and F. Illas, J. Chem. Phys. 115 (2001) 454-
465.
171. “Chemistry of NO2 on Oxide Surfaces: Formation of NO3 on TiO2(110) and
NO2↔O Vacancy Interactions”, J.A. Rodriguez, T. Jirsak, G. Liu, J. Hrbek, J. Dvorak, and
A. Maiti, J. Am. Chem. Soc. 123 (2001) 9597-9605.
172. “Formation of Mo and MoSx Nanoparticles on Au(111) from Mo(CO)6 and S2
Precursors: Electronic and Chemical Properties”, J.A. Rodriguez, J. Dvorak, T. Jirsak and
J. Hrbek, Surf. Sci. 490 (2001) 315-326.
173. “Sulfur Adsorption and Reaction with a TiO2(110) Surface: O-S Exchange
Mechanism and Sulfide Formation”, J. Hrbek, J.A. Rodriguez, J. Dvorak and T. Jirsak,
Collec. Czech. Chem. Commun. 66 (2001) 1149-1163.
174. “Orbital-Band Interactions and the Reactivity of Molecules on Oxide Surfaces: From
Explanations to Predictions”, J.A. Rodriguez, Theoretical Chem. Accounts, 107
(2002) 117-129 (invited).
175. “Reaction of SO2 with Pure and Metal-doped MgO: Basic Principles for the
Cleavage of S-O Bonds”, J.A. Rodriguez, T. Jirsak, L. Gonzalez, J. Evans, M. Perez, and A. Maiti, J.
Chem. Phys.115 (2001) 10914-10926.
176. “Experimental and Theoretical Studies on the Reaction of H2 with NiO: Role
of O Vacancies and Mechanism for Oxide Reduction”, J.A. Rodriguez, J.C. Hanson, A.I. Frenkel,
J.Y. Kim and M. Perez, J. Am. Chem. Soc. 124 (2002) 346-354.
177. “Chemistry of Sulfur-Containing Molecules on Au(111): Thiophene, Sulfur
Dioxide, and Methanethiol Adsorption”, G. Liu, J.A. Rodriguez, J. Dvorak, J. Hrbek and T. Jirsak,
Surf. Sci. 505 (2002) 295-307.
178. “A First-Principles Study of the Adsorption of Sulfur on Pt(111): S Core-Level
Shifts and the Nature of the Pt-S Bond”, Z. Yang, R. Wu and J.A. Rodriguez, Phys. Rev. B,
65 (2002) 155409-1,9.
179. “Interaction of Sulfur with Bimetallic Surfaces: Effects of Structural, Electronic
and Chemical Properties” J.A. Rodriguez and J. Hrbek, Chapter for: “The Chemical Physics of Solid
Surfaces and Heterogeneous Catalysis”, Vol. 10, chapter 13, Elsevier, Amsterdam, 2002. (invited)
180. “Reduction of CoMoO4 and NiMoO4: In-Situ Time-Resolved XRD Studies”,
J.A. Rodriguez, J.Y. Kim, J.C. Hanson, and J.L. Brito, Catal. Lett., 82 (2002) 103-109.
181. “Synthesis, Electronic and Chemical Properties of MoOx Clusters on Au(111)”,
Z. Chang, Z. Song, G. Liu, J.A. Rodriguez and J. Hrbek, Surf. Sci. 512 (2002) L353-L360.
182. “Activation of Gold on Titania: Adsorption and Reaction of SO2 on Au/ TiO2(110)”,
J.A. Rodriguez, G. Liu, T. Jirsak, J. Hrbek, Z. Chang, J. Dvorak, and A. Maiti, J. Am. Chem. Soc.
124 (2002) 5242-5250.
183. “Importance of Oxygen Vacancies in the Behavior of Oxide Surfaces: Adsorption of
Sulfur on TiO2(110)”, J.A. Rodriguez, J. Hrbek, Z. Chang, J. Dvorak, T. Jirsak and A. Maiti, Phys.
Rev. B, 65 (2002) 235414-1,12.
184. “Structural and Electronic Properties of PbTiO3, PbZrO3, and PbZr0.5Ti0.5O3: First-
principles Density-Functional Studies”, J.A. Rodriguez, A. Etxeberria, L. Gonzalez, and A. Maiti, J.
Chem. Phys. 117 (2002) 2699-2709.
185. “Adsorption of Methanethiol on Stoichiometric and Defective TiO2(110) Surfaces: A
Combined Experimental and Theoretical Study”, by G. Liu, J.A. Rodriguez, Z. Chang,
J. Hrbek, and L. Gonzalez, J. Phys. Chem. B, 106 (2002) 9883-9891.
186. “Reduction of CuO in H2: In Situ Time-Resolved XRD Studies”, J.A. Rodriguez, J.Y.
Kim, J.C. Hanson, M. Perez, and A. Frenkel, Catal. Lett. 85 (2003) 247-254.
187. “Electronic and Chemical Properties of Mixed-Metal Oxides: Adsorption of SO2 on
SrTiO3(001)”, J.A. Rodriguez, J. Garcia, and L. Gonzalez, Chem. Phys. Lett. 365 (2002) 380-386.
188. “Coverage Effects and the Nature of the Metal-Sulfur Bond in S/Au(111): High-
resolution Photoemission and Density-Functional Studies” J.A. Rodriguez, J. Dvorak, T. Jirsak, G.
Liu, J. Hrbek, Y. Aray and C. Gonzalez, J. Am. Chem. Soc. 125 (2003) 276-285.
189. “Electronic and Chemical Properties of Mixed-Metal Oxides: Adsorption and Reaction
of NO on SrTiO3(100)”, J.A. Rodriguez, S. Azad, L.-Q. Wang, J. Garcia, A. Etxeberria, and L.
Gonzalez, J. Chem. Phys. 118 (2003) 6562-6571.
190. “The deposition of Mo Nanoparticles on Au(111) from a Mo(CO)6 Precursor: Effects
of CO on Mo-Au Intermixing”, P. Liu, J.A. Rodriguez, J.T. Muckerman, and J. Hrbek, Surf. Sci. 530
(2003) L313-L321.
191. “Properties of CeO2 and Ce1-xZrxO2 Nanoparticles: XANES, Density Functional, and
Time-Resolved XRD Studies”, J.A. Rodriguez, J.C. Hanson, J.-Y. Kim, G. Liu, A. Iglesias-Juez and
M. Fernandez-Garcia, J. Phys. Chem. B, 107 (2003) 3535-3543.
192. “A Novel Growth Mode of Mo on Au(111) from a Mo(CO)6 Precursor: An STM
Study”, Z. Song, T. Cai, J.A. Rodriguez, J. Hrbek, A.S.Y. Chan, and C.M. Friend, J. Phys. Chem. B,
107 (2003) 1036-1043.
193. “Interaction of CO, O and S with Metal Nanoparticles on Au(111): A Theoretical
Study”, P. Liu, J.A. Rodriguez, J.T. Muckerman and J. Hrbek, Phys. Rev. B, 67 (2003) 155416-1,10.
194. “Physical and Chemical Properties of MoP, Ni2P and MoNiP
Hydrodesulfurization Catalysts: Time-Resolved X-ray Diffraction, Density Functional, and
Hydrodesulfurization Activity Studies”, J. A. Rodriguez, J.-Y. Kim, J. C. Hanson, S. J. Sawhill
and M. E. Bussell J. Phys. Chem. B, 107 (2003) 6276-6285.
195. “Electronic and Chemical Properties of Mixed-Metal Oxides: Basic Principles for
the Design of DeNOx and DeSOx Catalysis”, J. A. Rodriguez, Catalysis Today, 85 (2003) 177-
192 (invited).
196. “Interaction of Thiophene with Stoichiometric and Reduced Rutile TiO2(110)
Surfaces: Role of Ti3+ Sites in Desulfurization Activity”, G. Liu, J. A. Rodriguez and J. Hrbek
Journal of Molecular Catalysis, 202 (2003) 215-227.
197. “Reduction of CuO and Cu2O with H2: H Embedding and Kinetic Effects in the
Formation of Suboxides”, J. Y. Kim, J. A. Rodriguez, J. C. Hanson, A. I. Frenkel and P. L. Lee,
J. Am. Chem. Soc. 125 (2003) 10684-10692.
198. “Chemical Reactivity of Metcar Ti8C12, Nanocrystal Ti14C13 and A Bulk TiC(001)
Surface: A Density Functional Study”, P. Liu, J. A. Rodriguez, H. Hou and J. T. Muckerman
J. Chem. Phys. 118 (2003) 7737-7740.
199. “Ru Nanoclusters Prepared by Ru3(CO)12 Deposition on Au(111)”, T. Cai, Z.
Song, Z. Chang, G. Liu, J. A. Rodriguez and J. Hrbek, Surf. Sci. 538 (2003) 76-88.
200. “Molecular Level Study of the Formation and the Spread of MoO3 on Au(111) by
STM and XPS”, Z. Song, T. Cai, Z. Chang, G. Liu, J. A. Rodriguez, and J. Hrbek, J. Am. Chem.
Soc. 125 (2003) 8059-8066.
201. “Effects of Carbon on the Stability and Chemical Performance of Transition Metal
Carbides: A Density Functional Study”, P. Liu and J. A. Rodriguez J. Chem. Phys. 120 (2004)
5414-5423.
202. “Activation of Au Nanoparticles on Oxide Surfaces: Reaction of SO2 with
Au/MgO(100)”, J. A. Rodriguez, M. Perez, T. Jirsak, J. Evans, J. Hrbek and L. Gonzalez
Chem. Phys. Lett. 378 (2003) 526-532.
203. “The Behavior of Mixed-Metal Oxides: Structural and Electronic Properties of
Ce1-xCaxO2 and Ce1-xCaxO2-x”, J. A. Rodriguez, X. Wang, J. C. Hanson, G. Liu, A. Iglesias-Juez
and M. Fernández-García, J. Chem. Phys. 119 (2003) 5659-5669.
204. “Adsorption and Decomposition of SO2 on TiC(001): An Experimental and
Theoretical Study”, J. A. Rodriguez, P. Liu, J. Dvorak, T. Jirsak, J. Gomes, Y. Takahashi and K.
Nakaura, Surf. Sci. 543 (2003) L675-L682.
205. “SnO2 Nanoribbons as NO2 Sensors: Insights from First-principles Calculations”,
A. Maiti, J. A. Rodriguez, M. Law, P. Kung, J. R. McKinney and P. Yang, Nanoletters, 3 (2003)
1025-1028.
206. “A Computational Study of the Geometry and Properties of the Metcars Ti8C12
and Mo8C12”, H. Hou, J. T. Muckerman, P. Liu and J. A. Rodriguez, J. Phys. Chem. A, 107
(2003) 9344-9353.
207. “Adsorption and Reaction of SO2 on Model Ce1-xZrxO2(111) Catalysts”,
G. Liu, J. A. Rodriguez, Z. Chang, J. Hrbek and C. H. F. Peden, J. Phys. Chem. B 108 (2004)
2931-2938.
208. “In-Situ Time Resolved Powder Diffraction Studies in Heterogeneous Catalysis:
Coupling the Study of Long Range and Local Structural Changes”, P. J. Chupas, C. P. Grey, J.
C. Hanson, J.-Y. Kim, J. A. Rodriguez, X. Qiu, S. J. L. Billinge and P. L. Lee, Comm. Powder
Diffraction Newsletter 29 (2003) 24-25.
209. “Interaction of Sulfur Dioxide with Titanium-Carbide Nanoparticles and Surfaces:
A Density Functional Study”, P. Liu and J. A. Rodriguez, J. Chem. Phys. 119 (2003) 10895-
10903.
210. “Gold Nanoparticles on Titania: Activation and Behavior”, J. A. Rodriguez
In: Dekker Encyclopedia of Nanoscience, Dekker Publishing: New York, NY, 2004. Pages 1297-
1304 (invited).
211. “Catalytic Properties of Molybdenum Carbide, Nitride and Phosphide Catalysts:
A Theoretical Study”, P. Liu and J. A. Rodriguez, Catalysis Letters, 91 (2003) 247-252.
212. “Surface Science Studies of DeNOx Catalysts”, J. A. Rodriguez, In:
Environmental Catalysis, V.H. Grassian (editor) , Taylor & Francis: Boca Raton, Florida, 2005.
Chapter 9 (invited).
213. “The Adsorption of Sulfur on TiC(001): Photoemission and First-principles
Studies”, J. A. Rodriguez, P. Liu, J. Dvorak, T. Jirsak, J. Gomes, Y. Takahashi and K.
Nakamura, Phys. Rev. B, 69 (2004) 115414, 1-10.
214. “Structure and Reactivity of Ru Nanoparticles Supported on Modified Graphite
Surfaces: A Study of the Model Catalysts for Ammonia Synthesis”, Z. Song, T. Cai, J. C.
Hanson, J. A. Rodriguez and J. Hrbek, J. Am. Chem. Soc. 126 (2004) 8576.
215. “Physical and Chemical Properties of Bulk Ce1-xTbxO2 and Nanoparticles of
Ce1-xTbxOy”, J. A. Rodriguez, X. Wang, J. C. Hanson, G. Liu, A. Iglesias-Juez and M.
Fernández-García, J. Chem. Phys. 121 (2004) 5434-5444.
216. “Preparation and Structural Characterization of RuS2 Nano-Islands on Au(111)”,
T. Cai, Z. Song, J. A. Rodriguez and J. Hrbek, J. Am. Chem. Soc. 126 (2004) 8886-8887.
217. “The Interaction of Oxygen with TiC(001): Photoemission and First-Principles
Studies”, J. A. Rodriguez, P. Liu, J. Dvorak, T. Jirsak, J. Gomes, Y. Takahashi and K. Nakamura
J. Chem. Phys. 121 (2004) 465-474.
218. “Physical and Chemical Properties of Cel-xZrxO2 Nanoparticles and Cel-x
ZrxO2(111) Surfaces: Synchrotron-based Studies”, J. A. Rodriguez, X. Wang, G. Liu, J. Hanson,
J. Hrbek, C. H. F. Peden, A. Iglesias-Juez and M. Fernández-García, J. Molec. Catalysis A:
Chemical, 228 (2005) 11-19.
219. “Desulfurization of SO2 and Thiophene on Surfaces and Nanoparticles of
Molybdenum Carbide: Unexpected Ligand and Steric Effects”, P. Liu, J. A. Rodriguez and J. T.
Muckerman, J. Phys. Chem. B, 108 (2004) 15662-15670.
220. “Time-Resolved Studies for the Mechanism of Reduction of Copper Oxides with
Carbon Monoxide: Complex Behavior of Lattice Oxygen and the Formation of Suboxides”, X.
Wang, J.C. Hanson, A. Frenkel, J.-Y. Kim, and J.A. Rodriguez, J. Phys. Chem. B, 108 (2004)
13667-13673.
221. “Nanostructured Oxides in Chemistry: Characterization and Properties”, M.
Fernández-García, A. Martinez-Arias, J. C. Hanson and J. A. Rodriguez, Chem. Rev. 104 (2004)
4063-4104 (invited).
222. “A Systematic Density Functional Theory Study of the Electronic Structure of
Bulk and (001) Surface of Transition-Metals Carbides”, F. Viñes, C. Sousa, P. Liu, J.A.
Rodriguez and F. Illas, J. Chem. Phys., 122 (2005) 174709, 1-11.
223. “Interaction of H2O and NO2 with BaY Faujasite: Complex Contraction/
Expansion Behavior of the Zeolite Unit Cell”, X. Wang, J.C. Hanson, J. Szanyi, and J.A.
Rodriguez, J. Phys. Chem. B, 108 (2004) 16613-16616.
224. “XANES Characterization of Extremely Nanosized Metal Carbonyl Subspecies
(Me=Cr,Mn,Fe and Co) Confined onto the Mesopores of MCM-41 Materials”, J. M. Ramallo-
Lopez, E. J. Lede, F. G. Requejo, J. A. Rodriguez, J.-Y. Kim and R. Rosas-Salas, J. Phys. Chem.
B, 108 (2004) 20005-20010.
225. “Chemical Activity of Iron in [2Fe-2S]-Protein Centers and FeS2(100) Surfaces”,
J.A. Rodriguez and I. Abreu, J. Phys. Chem. B, 109 (2005) 2754-2762.
226. “The Chemical Activity of Metal Compound Nanoparticles: Importance of
Electronic and Steric Effects in M8C12 (M= Ti, V, Mo) Metcars”, P. Liu, J.A. Rodriguez and J.
Muckerman, J. Chem. Phys. 121 (2004) 10321-10324.
227. “Reaction of CuO with Hydrogen Studied by Using Synchrotron-Based X-ray
Diffraction”, J.Y. Kim, J.C. Hanson, A.I. Frenkel, P.L. Lee and J.A. Rodriguez, J. Phys. :
Condens. Matter, 16 (2004) S3479-S3484.
228. “Characterization of NOx Species in Dehydrated and Hydrated Na- and BaY,
FAU Zeolites formed in NO2 Adsorption” J. Szanyi, J.H. Kwak, S. Burton, J.A. Rodriguez and
C.H.F. Peden, J. Electron Spectroscopy and Related Phenomena, 150 (2006) 164-170.
229. “Theoretical Studies of Manganese and Iron Superoxide Dismutases: Superoxide
Binding and Superoxide Oxidation”, I. Abreu, J.A. Rodriguez and D.E. Cabelli, J. Phys. Chem.
B, 109 (2005) 24502-24509.
230. “Sulfur Adsorption and Sulfidation of Transition Metal Carbides as Hydrotreating
Catalysts”, P. Liu, J.A. Rodriguez and J.T. Muckerman, J. Molecular Catal. A: Chemical,
239 (2005) 116-124.
231. “The Chemisorption of SO2 on the Cu/Au(111) Surface: Interplay between
Ensemble and Electronic Effects”, X. Zhao, P. Liu, J. Hrbek, J.A. Rodriguez and M. Pérez, Surf.
Sci. 592 (2005) 25-36.
232. “Catalysis for Hydrogen Evolution from the [NiFe] Hydrogenase to the Ni2P(001)
Surface: The Importance of Ensemble Effect”, P. Liu and J.A. Rodriguez, J. Am. Chem. Soc.
127 (2005) 14871-14878.
233. “Reaction of SO2 with Au/CeO2(111): Importance of O Vacancies in the
Activation of Gold”, J.A. Rodriguez, M. Pérez, J. Evans, G. Liu and J. Hrbek, J. Chem. Phys.
122 (2005) 241101-1,4.
234. “Interaction of Oxygen with ZrC(001) and VC(001): Photoemission and First-
Principles Studies”, J.A. Rodriguez, P. Liu, J. Gomes, K. Nakamura, F.Viñes, C. Sousa, and F.
Illas, Phys. Rev. B, 72 (2005) 075427-1,11.
235. “XANES/EXAFS Study and Catalytic Properties of the Confined Cr Carbonyl-
MCM-41 System”, F.G. Requejo, J.M. Ramallo-Lopez, R. Rosas-Salas, J.M. Dominguez, J.A.
Rodriguez, J.-Y. Kim and R. Quijada, Catal. Today, 107-108 (2005) 750-758.
236. “In-situ Time-Resolved Characterization of Au-CeO2 and AuOx-CeO2 Catalysts
during the Water-Gas Shift Reaction: Presence of Au and O Vacancies in tha Active Phase”, X.
Wang, J.A. Rodriguez, J.C. Hanson, M. Pérez and J. Evans, J. Chem. Phys. 123 (2005) 221101-
1,5.
237. “Ca Doping of Nanosize Ce-Zr and Ce-Tb Solid Solutions: Structural and
Electronic Effects”, M. Fernández-García, X. Wang, C. Belver, A. Iglesias-Juez, J.C. Hanson
and J.A. Rodriguez, Chemistry of Materials, 17 (2005) 4181-4193.
238. “Reaction of SO2 with Cu/TiO2(110): Effects of Size and Metal-Oxide Interactions
in the Chemical Activation of Cu Nanoparticles”, X. Zhao, J. Hrbek, J.A. Rodriguez and M.
Pérez, Surface Science, 600 (2006) 229-239.
239. “In-situ Studies of the Active Sites for the Water Gas Shift Reaction over Cu-CeO2
Catalysts: Complex Interaction between Metallic Copper and Oxygen Vacancies on Ceria”, X.
Wang, J.A. Rodriguez, J.C. Hanson, D. Gamarra, A. Martinez-Arias and M. Fernández-García, J.
Phys. Chem. B, 110 (2006) 428-434.
240. “The Chemical Properties of Bimetallic Surfaces: Importance of Ensemble and
Electronic Effects in the Adsorption of Sulfur and SO2”, J.A. Rodriguez, Progress in Surface
Science, 81 (2006) 141-189 (invited).
241. “Gas-Phase Interaction of Thiophene with the Ti8C12+ and Ti8C12 Met-Car
Clusters”, P. Liu, J.L. Lightstone, M.J. Patterson, J.A. Rodriguez, J.T. Muckerman, and M.G.
White, J. Phys. Chem. B, 110 (2006) 7449-7455.
242. “Photoemission Study of Glycine Adsorption on Cu/Au(111) Interfaces”, X. Zhao
and J.A. Rodriguez, Surface Science, 600 (2006) 2113-2121.
243. “Comparative Study of Redox Properties of Nanosized CeO2 and CuO/CeO2 under
CO/O2”, A. Martinez-Arias, D. Gamarra, M. Fernández-García, X.Q. Wang, J.C. Hanson and
J.A. Rodriguez, J. Catal. 240 (2006) 1-7.
244. “N Doping of TiO2(110): Photoemission and Density-Functional Studies”, A.
Nambu, J. Graciani, J.A. Rodriguez, Q. Wu, E. Fujita, and J. Fdez Sanz, J. Chem. Phys. 125
(2006) 094706-1,8.
245. “Water-Gas-Shift Reaction in Molybdenum Carbide Surfaces: Essential Role of the
Oxycarbide”, P. Liu and J. A. Rodriguez, J. Phys. Chem. B, 110 (2006) 19418-19425.
246. “In-situ Characterization of Heterogeneous Catalysts using Time-resolved X-ray
Diffraction”, J.A. Rodriguez and J.C. Hanson, Ciencia, 14 (2006) 177-188 (invited).
247. “A DFT Study of the Dissociation of H2 on Gold Clusters: Importance of
Fluxionality and Ensemble Effects”, L. Barrio, P. Liu , J. A. Rodríguez , J. M. Campos-Martín,
and J.L.G. Fierro, J. Chem. Phys. 125 (2006) 164715-1,5.
248. “In situ Time-resolved Characterization of Novel Cu-MoO2 Catalysts during the
Water-Gas Shift Reaction”, W. Wen, L. Jing, M. G. White, N. Marinkovic, J.C. Hanson, and J.
A. Rodriguez, Catalysis Letters, 113 (2007) 1-6.
249. “Anatase-TiO2 Nanomaterials: Morphological/Size Dependence of the
Crystallization and Phase Behavior Phenomena”, M. Fernández-García, X. Wang, C. Belver, J.C.
Hanson, and J.A. Rodriguez, J. Phys. Chem. C, 111 (2007) 674-682.
250. “Unraveling the Origin of the High Catalytic Activity of Supported Au: A DFT-
based Interpretation”, N. Cruz Hernandez, J. Fdez Sanz and J.A. Rodriguez, J. Am. Chem. Soc.,
128 (2006) 15600-15601.
251. “Density Functional study of the adsorption of atomic oxygen on the (001) surface
of early transition metal carbides”, F. Viñes, C. Sousa, F. Illas, P. Liu and J. A. Rodriguez, J.
Phys. Chem. C, 111 (2007) 1307-1314.
252. “Water-Gas Shift Reaction on Cu and Au Nanoparticles Supported on CeO2(111)
and ZnO(000ī): Intrinsic Activity and Importance of Support Interactions”, J.A. Rodriguez, P.
Liu, J. Hrbek, J. Evans and M. Pérez, Angew. Chem. Intl. Ed., 46 (2007) 1329-1332 .
253. “Reaction of NH3 with TiO2: N-doping and the formation of TiN“, H. Chen, A.
Nambu, J. Graciani, J.C. Hanson, E. Fujita and J.A. Rodriguez, J. Phys. Chem. C, 111 (2007)
1366-1372.
254. “Are the surfaces of CrO2 metallic?“, C.A. Ventrice, D. R. Borst, H. Geisler, J. van
Ek, Y.B. Losovyj, P.S. Robbert, U. Diebold, J.A. Rodriguez, G.X. Miao and A. Gupta, J.
Physics: Condensed Matter, 19 (2007) 315207 (18pp).
255. “Gold Nanoparticles on Ceria: Importance of O vacancies in the Activation of
Gold“, J.A. Rodriguez, X. Wang, P. Liu, W. Wen, J.C. Hanson, J. Hrbek, M. Pérez, and J. Evans,
Topics in Catalysis, 44 (2007) 73-81.
256. “Sequential Transformations in Assemblies based on Octamolybdate Clusters and
1,2-bis(4-pyridyl)ethane”, R. Atencio, A. Briceño, P. Silva, J.A. Rodriguez and J.C. Hanson,
New J. Chem. 31 (2007) 33-38.
257. “STM and XPS Study of Growth of Ce on Au(111)”, S. Ma, X. Zhao, J.A.
Rodriguez, and J. Hrbek, J. Phys. Chem. C, 111 (2007) 3685-3691.
258. “Interaction of oxygen with TiN(001): N↔O exchange and oxidation process”,
J. Graciani, J. Fdez. Sanz, T. Asaki, K. Nakamura, and J. A. Rodriguez, J. Chem. Phys.,126
(2007) 244713-1,8.
259. “Reaction of Water with Ce-Au(111) and CeOx/Au(111) Surfaces: Photoemission
and STM studies”, X. Zhao, S. Ma, J. Hrbek and J. A. Rodriguez, Surf. Sci., 601 (2007) 2445-
2452.
260. “Water-Gas Shift Reaction on Metal Nanoparticles and Surfaces”, P. Liu and J.A.
Rodriguez, J. Chem. Phys. 126 (2007) 164705-1,8
261. “Effects of Hydrogen on the Reactivity of O2 towards Gold Nanoparticles and
Surfaces”, L. Barrio, P. Liu, J. A. Rodriguez, J. M. Campos-Martin, and J. L.G. Fierro, J. Phys.
Chem. C, 111 (2007) 19001-19008.
262. “Water-Gas Shift Activity of Au and Cu Nanoparticles supported on Molybdenum
Oxides”, J. A. Rodriguez, P. Liu, J. Hrbek , M. Pérez and J. Evans, J. Molecular Catal. A, 281
(2008) 59-65.
263. “A Systematic Density Functional Study of Molecular Oxygen Adsorption and
Dissociation on the (001) Surface of Group IV-VI Transition Metal Carbides”, F. Viñes, C.
Sousa, F. Illas, P. Liu and J.A. Rodriguez, J. Phys. Chem. C, 111 (2007) 16982-16989.
264. “Structure-Activity Relationships in Nanostructured Catalysts Copper-Ceria Based
Preferential CO Oxidation Catalysts”, D. Gamarra, G. Munuera, A.B. Hungria, M. Fernandez-
Garcia, J. Conesa, P.A. Midgley, X. Wang, J.C. Hanson, J.A. Rodriguez, and A. Martinez-Arias,
J. Phys. Chem. C. 111 (2007) 11026-11038.
265. “Anatase-TiO2 Nanomaterials: Analysis of Key Parameters Controlling
Crystallization”, M. Fernández-García, C. Belver, J.C. Hanson, X. Wang, and J.A. Rodriguez, J.
Am. Chem. Soc. 129 (2007) 13604-13612.
266. “Adsorption of gold on TiC(001): Au-C interactions and charge polarization”, J.A.
Rodriguez, F. Viñes, F. Illas, P. Liu, Y. Takahashi and K. Nakamura, J. Chem. Phys. 127 (2007)
211102-1,4.
267. “Activity of CeOx and TiOx Nanoparticles Grown on Au(111) in the Water-Gas
Shift Reaction”, J.A. Rodriguez, S. Ma, P. Liu, J. Hrbek, J. Evans and M. Perez, Science, 318
(2007) 1757-1760.
268. “Proline Adsorption on TiO2(110) Single Crystal Surface: A Study by High
Resolution Photoelectron Spectroscopy”, G.J. Fleming, K. Adib, J.A. Rodriguez, M.A. Barteau,
and H. Idriss, Surf. Sci. 601 (2007) 5726-5731.
269. “N doping of Rutile TiO2(110) Surface: A Theoretical DFT Study”, J. Graciani, L.J.
Alvarez, J.A. Rodriguez, and J. Fdez-Sanz, J. Phys. Chem. C, 112 (2008) 2624-2631.
270. “Formation of Pd/Au Nanostructures from Pd Nanowires via Galvanic Replacement
Reaction”, X. Teng, Q. Wang, P. Liu, W.-Q. Han, A. Frenkel, W. Wen, N. Marinkovic, J.C.
Hanson and J.A. Rodriguez, J. Am. Chem. Soc. 130 (2008) 1093-1101.
271. “In-situ Time-resolved Characterization of Ni-MoO2 Catalysts for the Water-Gas
Shift Reaction”, W. Wen, J.E. Calderon, J.L. Brito, N. Marinkovic, J.C. Hanson, and J.A.
Rodriguez, J. Phys. Chem. C, 112 (2008) 2121-2128.
272. “Dissociation of SO2 on Au/TiC(001): Effects of Au-C Interactions and Charge
Polarization”, J.A. Rodriguez, P. Liu, F. Viñes, F. Illas, Y. Takahashi, and K. Nakamura, Angew.
Chem. Intl. Ed. 47 (2008) 6685-6689.
273. “Au↔N Synergy and N-Doping of Metal Oxide-Based Photocatalysts”, J. Graciani,
A. Nambu, J. Evans, J.A. Rodriguez and J. Fernandez-Sanz, J. Am. Chem. Soc. 130 (2008)
12056-12063.
274. “Ceria-based Catalysts for the Production of H2 through the Water-Gas Shift
Reaction: Time-resolved XRD and XAFS Studies”, X. Wang, J.A. Rodriguez, J.C. Hanson, D.
Gamarra, A Martinez-Arias, and M. Fernandez-García, Top. Catal. 49 (2008) 81-88.
275. “STM Study of the Growth of Cerium Oxide Nanoparticles on Au(111)”, S. Ma,
J.A. Rodriguez, and J. Hrbek, Surf. Sci. 602 (2008) 3272-3278.
276. “Catalysts Size Matters: Tuning the Molecular Mechanism of the Water-Gas Shift
Reaction on Titanium Carbide Based Compounds”, F. Viñes, J.A. Rodriguez, P. Liu, and F. Illas,
J. Catal. 260 (2008) 103-112.
277. “Synthesis, Characterization, and Photodegradation Behavior of Single-Phase
Anatase TiO2 Materials Synthesized from Ti-Oxychloride Precursors”, G. Colon, P. Sampedro,
M. Fernandez-García, H. Chen, J.C. Hanson, and J.A. Rodriguez, Langmuir, 24 (2008) 11111-
11118.
278. “Water-Gas Shift Activity of Cu Surfaces and Cu Nanoparticles Supported on
Metal Oxides”, J.A. Rodriguez, P. Liu, X. Wang, W. Wen, J.C. Hanson, J. Hrbek, M. Pérez and
J. Evans, Catal. Today, 143 (2009) 45-50.
279. “Water-gas-shift reaction on a Ni2P(001) catalyst: Formation of oxy-phosphides
and highly active reaction sites”, P. Liu, J.A. Rodriguez, Y. Takahashi, and K. Nakamura, J.
Catal., 262 (2009) 294-303.
280. “Preparation of (Ga1-xZnx)(N1-xOx) Photocatalysts from the Reaction of NH3 with
Ga2O3 / ZnO and ZnGa2O4: In-situ Time-Resolved XRD and XAFS Studies”, H. Chen, W. Wen,
Q.Wang, J. C. Hanson, J. T. Muckerman, E. Fujita, A. I. Frenkel, and J. A. Rodriguez , J. Phys.
Chem. C, 113 (2009) 3650-3659.
281. “In-situ Characterization of Water-Gas Shift Catalysts using Time-resolved X-ray
Diffraction”, J.A. Rodriguez , J.C. Hanson, W. Wen, and X. Wang, Catal. Today, 145 (2009)
188-194 (invited).
282. “Methanethiol Chemistry on TiO2-supported Ni Clusters”, O. Ozturk, J.B. Park,
T.J. Black, J.A. Rodriguez, J. Hrbek and D.A. Chen, Surf. Sci. 602 (2008) 3077-3088.
283. “High Water-Gas Shift Activity in TiO2(110) supported Cu and Au Nanoparticles:
Role of the Oxide and Metal Particle Size", J. Rodriguez, J. Evans, J. Graciani, J.-B. Park, P. Liu,
J. Hrbek, and J. Fernandez-Sanz, J. Phys. Chem. C, 113 (2009) 7364-7370.
284. “Adsorbate-driven Morphological Changes of a Gold Surface at Low
Temperatures”. J. Hrbek, F.M. Hoffmann, J.B. Park, P. Liu, D. Stacchiola, Y.S. Hoo, S. Ma, A.
Nambu, J.A. Rodriguez, and M.G. White, J. Am. Chem. Soc. 130 (2008) 17272-17273.
285. “Theoretical Studies in Heterogeneous Catalysis: Towards a Rational Design of
Novel Catalysts for Hydrodesulfurization and Hydrogen Production”, J.A. Rodriguez and P. Liu,
in New Developments in Quantum Chemistry, Transworld Research Network (2008), invited
book chapter.
286. “High Catalytic Activity of Au/CeOx/TiO2(110) Controlled by the Nature of the
Mixed-Metal Oxide at the Nanometer Level”, J.B. Park, J. Graciani, J. Evans, D. Stacchiola, S.
Ma, P. Liu, A. Nambu, J. Fernandez-Sanz, J. Hrbek, and J.A. Rodriguez, Proceedings of the
National Academy of Science (PNAS), 106 (2009) 4975-4980.
287. “Adsorption and Diffusion of Au Atoms on the (001) Surface of Ti, Zr, Hf, V, Nb,
Ta, and Mo Carbides”, E. Florez, F. Viñes, J.A. Rodriguez, and F. Illas, J. Chem. Phys. 130
(2009) 2444706-1,7.
288. “In-situ Characterization of CuFe2O4 and Cu/Fe3O4 Water-Gas Shift Catalysts”,
M. Estrella, L. Barrio, G. Zhou, X. Wang, Q. Wang, W. Wen, J.C. Hanson, A.I. Frenkel, and
J.A. Rodriguez, J. Phys. Chem. B, 113 (2009) 14411.
289. “Desulfurization of Thiophene on Au/TiC(001): Au-C Interactions and Charge
Polarization”, J.A. Rodriguez, P. Liu, Y. Takahashi, K. Nakamura, F. Viñes, and F. Illas, J. Am.
Chem. Soc. 131 (2009) 8592-8602.
290. “Destruction of SO2 on Au and Cu Nanoparticles Dispersed on MgO(100) and
CeO2(111)”, J.A. Rodriguez, P. Liu, M. Pérez, G. Liu, and J. Hrbek, J. Phys. Chem. A, 114
(2010) 3802-3810.
291. “Effect of the Support on the Electronic Structure of Au Nanoparticles Supported
on Transition Metal Carbides: Choice of the best substrate for Au activation”, E. Florez, L. Feria,
F. Viñes, J.A. Rodriguez, and F. Illas, J. Phys. Chem. C, 113 (2009) 19994-20001.
292. “Water-Gas Shift Reaction on a Highly Active Inverse CeOx/Cu(111) Catalyst:
Unique Role of Ceria Nanoparticles”, J.A. Rodriguez, J. Graciani, J. Evans, J.B. Park, F. Yang,
D. Stacchiola, S.D. Senanayake, S. Ma, M. Perez, P. Liu, J.F. Sanz, and J. Hrbek, Angew. Chem.
Int. Ed., 48 (2009) 8047.
293. “Desulfurization Reactions on Surfaces of Metal Carbides: Photoemission and
Density-Functional Studies”, J.A. Rodriguez, P. Liu, Y. Takahashi, K. Nakamura, F. Viñes, and
F. Illas, Topics in Catalysis, 53 (2010) 393-402 (invited article).
294. “The Interaction of CO with OH on Au(111): HCOO, CO3 and HOCO
as Key Intermediates in the Water-Gas Shift Reaction”, S.D. Senanayake, D. Stacchiola, P. Liu,
B.C. Mullins, J. Hrbek, and J.A. Rodriguez, J. Phys. Chem. C, 113 (2009) 19536-19544.
295. “Role of C and P Sites on the Chemical Activity of Metal Carbides and
Phosphides: From Clusters to Single-Crystal Surfaces”, J.A. Rodriguez, F. Viñes, P. Liu and F.
Illas, Model Systems in Catalysis, R. Rioux (Editor), Springer : Berlin, 2009 (invited).
296. “A Comparative Study of the Water Gas Shift Reaction over Platinum Catalysts
Supported on CeO2, TiO2 and Ce-modified TiO2”, I.D. Gonzalez, R.M. Navarro, W. Wen, N.
Marinkovic, J.A. Rodriguez, F. Rosa, J.L.G. Fierro, Catal. Today, 149 (2010) 372-379.
297. “In Situ XRD Studies of ZnO/GaN Mixtures at High Pressure and High
Temperature: Synthesis of Zn-rich (Ga1-xZnx)(N1-xOx) Photocatalysts”, H. Chen, L.Wang, J. Bai,
J.C. Hanson, J.B. Warren, J.T. Muckerman, E. Fujita, and J.A. Rodriguez, J. Phys. Chem. C, 114
(2010) 1809-1814.
298. “Inverse Oxide/Metal Catalysts: A Versatile Approach for Activity Tests and
Mechanistic Studies”, J.A. Rodriguez and J. Hrbek, Surf. Sci. 604 (2010) 241-244 (invited).
299. “Inverse CeO2/CuO Catalyst as an Alternative to Classical Direct Configurations
for Preferential Oxidation of CO in Hydrogen-rich Stream”, A. Hornés, A.B. Hungría, P. Bera,
A. López Cámara, M. Fernández-García, A. Martínez-Arias, L. Barrio, M. Estrella, G. Zhou, J.J.
Fonseca, J.C. Hanson, and J.A. Rodríguez, J. Am. Chem. Soc. 132 (2010) 34-35.
300. “Theoretical Analysis of the Adsorption of Late Transition Metal Atoms on the
(001) Surface of Early Transition Metal Carbides”, T. Gόmez, E. Florez, J.A. Rodriguez and F.
Illas, J. Phys. Chem. C, 114 (2010) 1622-1626.
301. “Gold, Copper and Platinum Nanoparticles dispersed on CeOx/TiO2(110) Surfaces:
High Water-Gas Shift Activity and the Nature of the Mixed-Metal Oxide at the Nanometer
Level”, J.B. Park, J. Graciani, J. Evans, D. Stacchiola, S.D. Senanayake, L. Barrio, P. Liu, J.F.
Sanz, J. Hrbek, and J.A. Rodriguez, J. Am. Chem. Soc., 132 (2010) 356-363.
302. “Probing the Reaction Intermediates for the Water-Gas Shift over Inverse
CeOx/Au(111) Catalysts”, S.D. Senanayake, D. Stacchiola, J. Evans, M. Estrella, L. Barrio, M.
Pérez, J. Hrbek, and J.A. Rodriguez, J. Catal. 271 (2010) 392-400.
303. “Role of Au-C interactions on the catalytic activity of Au nanoparticles supported
on TiC(001) towards molecular oxygen dissociation”, J.A. Rodríguez, L. Feria, T. Jirsak, Y.
Takahashi, K. Nakamura, and F. Illas, J. Am. Chem. Soc. 132 (2010) 3177-3186.
304. “A Theoretical Insight into the Catalytic Effect of a Mixed-Metal Oxide at the
Nanometer Level: The Case of the Highly Active Metal/CeOx/TiO2(110) Catalysts”, J. Graciani,
J.J. Plata, J.F. Sanz, P. Liu and J.A. Rodriguez, J. Chem. Phys. 132 (2010) 104703-1,8.
305. “Novel Au-TiC Catalysts for CO Oxidation and Desulfurization Processes”, J.A.
Rodriguez, P. Liu, Y. Takahashi, F. Viñes, L. Feria, E. Florez, K. Nakamura, and F. Illas, Catal.
Today, 166 (2011) 2-9.
306. “Catalysis and the Nature of Mixed-Metal Oxides at the Nanometer Level: Special
Properties of MOx/TiO2(110) {M= V, W, Ce} Surfaces”, J.A. Rodriguez and D. Stacchiola,
Phys. Chem. Chem. Phys., 12 (2010) 9557-9565 (invited).
307. “Fundamental studies of Methanol Synthesis from CO2 Hydrogenation on Cu(111),
Cu Clusters, and Cu/ZnO(000ī)”, Y. Yang, J. Evans, J.A. Rodriguez, M.G. White, and P. Liu,
Phys. Chem. Chem. Phys., 12 (2010) 9909-9917.
308. “Unusual Physical and Chemical Properties of Ni in Ce1-xNixO2-y Oxides: Structural
Characterization and Catalytic Activity for the Water Gas Shift Reaction”, L. Barrio, A.
Kubacka, G. Zhou, M. Estrella, A. Martinez-Arias, J. C. Hanson, M. Fernandez-Garcia, and J. A.
Rodriguez, J. Phys. Chem. C, 114 (2010) 12689-12697.
309. “Hydrogen Reactions on Au/TiC(001): Effects of Au-C Interactions on the
Dissociation of H2”, E. Florez, T. Gomez, P. Liu, J.A. Rodriguez, and F. Illas, Chem. Catal.
Chem. 2 (2010) 1-4.
310. “Autocatalytic Reduction of a Cu2O/Cu(111) Surface by CO: STM, XPS and DFT
Studies”, F. Yang, Y.-M. Choi, P. Liu, J. Hrbek, and J.A. Rodriguez, J. Phys. Chem. C, 114
(2010) 17042-17050.
311. “High Activity of Ce1-xNixO2-y for H2 Production through Ethanol Steam
Reforming: Tuning Catalytic Performance through Metal↔Oxide Interactions”, G. Zhou, L.
Barrio, S. Agnoli, S.D. Senanayake, J. Evans, A. Kubacka, M. Estrella, J.C. Hanson, A.
Martínez-Arias, M. Fernández-García, and J.A. Rodriguez, Angew. Chem. Int. Ed. 49 (2010)
9680-9684.
312. “Unraveling the Active Site in Copper−Ceria Systems for the Water−Gas Shift
Reaction: In Situ Characterization of an Inverse Powder CeO2−x/CuO−Cu Catalyst”, L. Barrio,
M. Estrella, G. Zhou, W. Wen, J.C. Hanson, A. B. Hungría, A. Hornés, M. Fernández-García, A.
Martínez-Arias and J. A. Rodriguez, J. Phys. Chem.C, 114 (2010) 3580-3587.
313. “Reactivity of transition metals (Pd, Pt, Cu, Ag, Au) towards molecular hydrogen
dissociation: extended surfaces versus particles supported on TiC(001) or small is not always better
and large is not always bad”, T. Gomez, E. Florez, J. A. Rodriguez and F. Illas, J. Phys. Chem. C,
115 (2011) 11666-11672
314. “CO Oxidation on Inverse CeOx/Cu(111) Catalysts: High Catalytic Activity and
Ceria-Promoted Dissociation of O2”, F. Yang, J. Graciani, J. Evans, P. Liu, J. Hrbek, J. Fdez.
Sanz, and J.A. Rodriguez, J. Am. Chem. Soc. 133 (2011) 3444-3451.
315. “Interaction of SO2 with Cu/TiC(001) and Au/TiC(001): Towards a New Family of
DeSOx Catalysts”, L. Feria, J. A. Rodriguez, T. Jirsak, F. Illas, J. Catal., 279 (2011) 352-360.
316. “Water-Gas Shift and CO Methanation Reactions over Ni-CeO2(111) Catalysts”,
S.D. Senanayake, J. Evans, S. Agnoli, L. Barrio, T.-L. Chen, J. Hrbek and J.A. Rodriguez,
Topics in Catal. 54 (2011) 34-41.
317. “Identification of 5-7 Defects in a Copper Oxide Surface”, F.Yang, Y.M. Choi, P. Liu,
D. Stacchiola, J. Hrbek and J.A. Rodriguez, J. Am. Chem. Soc. 133 (2011) 11474-11477.
318. “On the Dissociation of Molecular Hydrogen by Au Supported on Transition Metal
Carbides: Choice of the Most Active Support”, E. Florez, T. Gomez, J. A. Rodriguez, and F. Illas,
Phys. Chem. Chem. Phys., 13 (2011) 6865-6871.
319. “Morphological and Structural Changes during the Reduction and Reoxidation of
CuO/CeO2 and Ce1-xCuxO2 Nanocatalysts: In-situ Studies with Environmental TEM, XRD and
XAS”, J. Ciston, R. Si, J.A. Rodriguez, J.C. Hanson, A. Martínez-Arias, M. Fernandez-García,
and Y. Zhu, J. Phys. Chem. C, 115 (2011) 13851-13859.
320. “Combining X-ray Absorption and X-ray Diffraction Techniques for in Situ
Studies of Chemical Transformations in Heterogeneous Catalysis: Advantages and Limitations”,
A. Frenkel, Q. Wang, N. Marinkovic, J.G. Chen, L. Barrio, R. Si, A. Lopez-Camara, A.M.
Estrella, J.A. Rodriguez and J.C. Hanson, J. Phys. Chem. C, 115 (2011) 17884-17890.
321. “Unravelling the Behaviour of RuOx nanoparticles in Mixed-Metal Oxides:
Special Structural and Catalytic Properties of RuO2/TiO2(110) Surfaces", F. Yang, S. Kundu,
A.B. Vidal, P.J. Ramírez, S.D. Senanayake, D. Stacchiola, J. Evans, P. Liu and J.A. Rodriguez,
Angew. Chem. Int. Ed., 50 (2011) 10198-10202.
322. “Theoretical study of the interaction of CO on TiC(001) and Au nanoparticles
supported on TiC(001): probing the nature of the Au/TiC interface”, G.G. Asara, L. Feria, E.
Florez, J. M. Ricart, P. Liu, J. A. Rodriguez, and F. Illas, J. Phys. Chem. C, 115 (2011) 22495-
22504.
323. “CeO2↔CuOx Interactions and the Controlled Assembly of CeO2(111) and
CeO2(100) Nanoparticles on an Oxidized Cu(111) Substrate”, F.Yang, Y.M. Choi, S. Agnoli, P.
Liu, D. Stacchiola, J. Hrbek and J.A. Rodriguez, J. Phys. Chem. C, 115 (2011) 23062-23066.
324. “Theoretical Study of the Interaction of CO on TiC(001) and Au Nanoparticles
Supported on TiC(001): Probing the Nature of the Au/TiC Interface”, G. G. Asara, L. Feria, E.
Florez, J. M. Ricart, P. Liu, J. A. Rodriguez, and F. Illas, J. Phys. Chem. C, 115 (2011) 22495-
22504
325. “In situ characterization of Pt catalysts supported on ceria modified TiO2 for the
WGS reaction: influence of ceria loading on catalytic behavior”, L. Barrio, G. Zhou, I. D.
González, M. Estrella, J. Hanson, J. A. Rodriguez, R. M. Navarro and J. L. G. Fierro, Phys.
Chem. Chem. Phys., 14 (2012) 2192-2202.
326. “Activation of Noble Metals on Metal-Carbide Surfaces: Novel Catalysts for CO
Oxidation, Desulfurization and Hydrogenation Reactions”, J. A. Rodriguez and F. Illas, Phys.
Chem. Chem. Phys., (invited) 14 (2012) 427-428.
327. “Gold-based Catalysts for the Water–gas Shift Reaction: Active Sites and
Reaction Mechanism”, J.A. Rodriguez, Catal. Today, 160 (2011) 3-10.
328. “Supported Gold in CO Oxidation, the Water-gas Shift, and DeSOx Reactions”,
J.A. Rodriguez, book chapter for Supported Metals in Catalysis, 2nd Edition (Editors: James
Anderson and Marcos Fernandez-Garcia), Imperial College Press, London, 2012 (invited book
chapter).
329. “Special Chemical Properties of RuOx Nanowires in RuOx/TiO2(110):
Dissociation of Water and Hydrogen Production”, S. Kundu, A.B. Vidal, F. Yang, P. J. Ramírez,
S. D. Senanayake, D. Stacchiola, J. Evans, P. Liu, and J.A. Rodriguez, J. Phys. Chem. C, 116
(2012) 4767–4773.
330. “Nanopatterning in CeOx/Cu(111): A New Mechanism for Surface Reconstruction
and Enhancement of Catalytic Activity”, S. D. Senanayake1, J. Sadowski, Jaime Evans, S.
Kundu, S. Agnoli, F. Yang, D. Stacchiola, J.I. Flege, J. Hrbek, and J.A. Rodriguez, J. Phys,
Chem. Letters, 3 (2012) 839-843.
331. “A New Type of Strong Metal-Support Interaction and the Production of H2
through the Transformation of Water on Pt/CeO2(111) and Pt/CeOx/TiO2(110) Catalysts”, A.
Bruix, J.A. Rodriguez, P.J. Ramirez, S.D. Senanayake, J. Evans, J.B. Park, D. Stacchiola, P. Liu,
J. Hrbek, and F. Illas, J. Am. Chem. Soc. 134 (2012) 8968-8974.
332. “In situ Studies of CeO2-supported Pt, Ru, and Pt–Ru Alloy Catalysts for the
Water–gas Shift Reaction: Active Phases and Reaction Intermediates”, W. Xu, R. Si, S. D.
Senanayake, J. Llorca, H. Idriss, D. Stacchiola, J. C. Hanson, J. A. Rodriguez, J. Catal. 291
(2012) 117-126.
333. “Exploring the Structural and Electronic Properties of Pt/Ceria-modified TiO2 and
its Photocatalytic Activity for Water Splitting under Visible Light”, S. Kundu, J. Ciston, S.D.
Senanayake, D.A. Arena, E. Fujita, D. Stacchiola, L. Barrio, R.M. Navarro, J.L.G. Fierro, and
J.A. Rodriguez, J. Phys. Chem. C, 116 (2012) 14062−14070.
334. “CO2 Activation and Methanol Synthesis on Novel Cu/TiC and Au/TiC Catalysts”,
A.B. Vidal, L. Feria, J. Evans, Y. Takahashi, P. Liu, K. Nakamura, F. Illas, and J.A. Rodriguez,
J. Phys. Chem. Lett., 3 (2012) 2275-2280.
335. “Tungsten as an Interface Agent Leading to Highly Active and Stable Cu-Ce Water
Gas Shift Catalyst”, A. Kubacka, R. Si, P. Michorczyk, A. Martínez-Arias, W. Xu, J. C. Hanson, J.
A. Rodriguez, and M. Fernández-García, Applied Catal. B : Environmental, 132/133 (2012) 423-
432.
336. “CO Oxidation on Inverse Fe2O3/Au(111) Model Catalysts”, Ting Yan, D. W.
Redman, W.-Y. Yu, D. W. Flaherty, J. A. Rodriguez, and C. B. Mullins, J. Catal. 294 (2012)
216-222.
337. “Operando Characterization of Iron-promoted Ceria-alumina Gold Catalysts
during the Water-gas Shift Reaction”, T. Ramírez Reina, W. Xu, S. Ivanova, M.A. Centeno, J.
Hanson, J. A. Rodriguez, and J. A. Odriozola, Catal. Today, 205 (2013) 41- 48.
338. “Goals and Challenges for the In-situ Characterization of Heterogeneous
Catalysts”, J.A. Rodriguez, J.C. Hanson and P.J. Chupas, in: In-situ Characterization of
Heterogeneous Catalysts, Editors: J.A. Rodriguez, J.C. Hanson and P.J. Chupas; Wiley: New
York, 2013.
339. “Unique Properties of Ceria Nanoparticles Supported on Metals: Novel Inverse
Ceria/Copper catalysts for CO Oxidation and the Water-Gas Shift Reaction”, S. D. Senanayake,
D. Stacchiola, and Jose A. Rodriguez, Accounts of Chemical Research, invited (2013) (invited).
340. “Active Sites of Gold-Ceria Nanorods for Low-Temperature CO Oxidation
Reaction: Operando X-Ray Diffraction and X-Ray Absorption Studies”, R. Si ,W. Xu , J. A.
Rodriguez, J. C. Hanson, J. Tao, and Y. Zhu, Catal. Today, submitted (2012).
341. “In-situ/Operando Studies for the Production of Hydrogen through the Water-Gas
Shift on Metal Oxide/Catalysts”, J.A. Rodriguez, J. C. Hanson, D. Stacchiola and S.
Senanayake, Phys. Chem. Chem. Phys. 15 (2013) 12004-12025 (invited).
342. “Synchrotron Techniques for In-situ Catalytic Studies: Capabilities, Challenges
and Opportunities”, A. I. Frenkel, J. A. Rodriguez, and J. G. Chen, ACS Catalysis, 2 (2012)
2269- 2280 (invited).
343. “Fundamental studies of well-defined surfaces of mixed-metal oxides: Special
properties of MOx/TiO2(110) {M= V, Ru, Ce or W}”, D. J. Stacchiola, S. Senanayake, P. Liu
and J. A. Rodriguez, Chemical Reviews, 113 (2013) 4373-4390 (invited).
344. “Effect of Ceria on Gold-Titania Catalysts for the Water-Gas Shift Reaction:
Fundamental Studies for Au/CeOx/TiO2(110) and Au/CeOx/TiO2 Powders”, R. Si , J. Tao, J.
Evans, J. B. Park, L. Barrio , J. C. Hanson, Y. Zhu, J. Hrbek and J.A. Rodriguez, J. Phys. Chem.
C, 116 (2012) 23547-23555
345. “Unraveling the nature of the oxide-metal interaction in ceria-based noble metal
inverse catalysts”, J. Graciani, A. Vidal, J. A. Rodriguez and J. Fdez. Sanz, J. Phys. Chem. C,
submitted (2012).
346. “Nature of the Mixed-Oxide Interface in Ceria–Titania Catalysts: Clusters, Chains,
and Nanoparticles”, A.C. Johnston-Peck, S. D. Senanayake, J.J. Plata, S. Kundu, W. Xu, L.
Barrio, J. Graciani, J. Fdez. Sanz, R.M. Navarro, J.L.G. Fierro, E. A. Stach, and J. A. Rodriguez,
J. Phys. Chem. C, 117 (2013) 14463-14872.
347. “Theoretical studies for the adsorption of CO and C on Ni(111) and Ni/CeO2(111):
Evidence for a strong metal-support interaction”, J. Carrasco, L. Barrio , P. Liu, J.A. Rodriguez,
and M.V. Ganduglia-Pirovano, J. Phys. Chem. C, 117 (2012) 8241-8247.
348. “Characterization of Metal-Oxide Catalysts in Operando Conditions by Combining
X-Ray Absorption and Raman Spectroscopies in the Same Experiment”, A. Patlolla, Ph.
Baumann, W. Xu, S. D. Senanayake, J. A. Rodriguez, and A. I. Frenkel, Topics in Catal. 56
(2013) 896-904.
349. “Steam reforming of ethanol on Ni/CeO2: Reaction pathway and interaction
between Ni and the CeO2 support”, W. Xu, Z. Liu , A. Johnston-Peck, S.D. Senanayake , G.
Zhou , D. Stacchiola, E. Stach and J.A. Rodriguez , ACS Catalysis, 3 (2013) 975–984.
350. “Ethanol Photo Reaction on RuOx/Ru Modified TiO2(110)”, S. Kundu, A. Vidal,
A. Nadeem, S. Senanayake, H. Idriss, P. Liu, J.A. Rodriguez and D. Stacchiola, J. Phys. Chem.
C. 117 (2013) 11149−11158.
351. “Platinum-Modulated Cobalt Nanocatalysts for Low-Temperature Aqueous-Phase
Fischer−Tropsch Synthesis”, H.Wang, W. Zhou, J.-X. Liu, R. Si, G. Sun, M.-Q. Zhong, H.-Y.
Su, H.-B. Zhao, J. A. Rodriguez, S. J. Pennycook, J. C. Idrobo, W.-X. Li, Y. Kou, and D. Ma,
J. Am. Chem. Soc. 135 (2013) 4149-4158.
352. “Atomic and Electronic Structure of Molybdenum Carbide Phases: Bulk and Low
Miller-Index Surfaces”, J.R. dos Santos Politi, F. Viñes, J. A. Rodriguez, and F. Illas, Physical
Chemistry Chemical Physics, 15 (2013) 12617-12625.
353. “Importance of the Metal–Oxide Interface in Catalysis: In Situ Studies of the
Water–Gas Shift Reaction by Ambient-Pressure X-ray Photoelectron Spectroscopy”, K.
Mudiyanselage, S.D. Senanayake, L. Feria, S. Kundu, A.E. Baber, J. Graciani, A.B. Vidal, S.
Agnoli, J. Evans, R. Chang, S. Axnanda, Z. Liu, J.F. Sanz, P. Liu, J.A. Rodriguez, and D.J.
Stacchiola, Angew. Chem. Intl. Ed. 52 (2013) 5101-5105.
354. “Structure and Special Chemical Reactivity of Interface Stabilized Cerium Oxide
Nanolayers on TiO2(110)”, S. Agnoli, A. E. Reeder, S. D. Senanayake, J. Hrbek and J.A.
Rodriguez, Nanoscale, 6 (2014) 800-810.
355. “CO2 Hydrogenation on Au/TiC, Cu/TiC and Ni/TiC Catalysts: Production of CO,
Methanol and Methane”, J.A. Rodriguez, J. Evans, L. Feria, A. B. Vidal, P. Liu, K. Nakamura,
and F. Illas, J. Catal. 307 (2013) 162-169.
356. “Electronic Metal-Support Interactions and the Production of Hydrogen through
the Water-gas Shift Reaction and Ethanol Steam Reforming: Fundamental Studies with Well-
defined Model Catalysts”, S.D. Senanayake, J.A. Rodriguez and D. Stacchiola, Topics in Catal.
56 (2013) 1488-1498.
357. “The Activation of Gold and the Water-Gas Shift Reaction: Insights from Studies
with Model Catalysts”, J.A. Rodriguez, S.D. Senanayake, D. Stacchiola, P. Liu and J, Hrbek,
Accounts of Chemical Research 47 (2014) 773-782 (invited).
358. “Improving the CO-PROX Performance of Inverse CeO2/CuO Catalysts: Doping of
the CuO Component with Zn”, A. Lopez Camara, V. Cortes Corberan, L. Barrio, G. Zhou, R. Si,
J.C. Hanson, M. Monte, J.C. Conesa, J.A. Rodriguez, and A. Martinez-Arias, J. Phys. Chem. C,
118 (2014) 9030–9041.
359. “When Reconstruction Comes Around: Ni, Cu, and Au Adatoms on δ-MoC(001)”,
G. G. Asara, F. Viñes, J. M. Ricart, J.A. Rodriguez and F. Illas, Surf. Sci. 624 (2014) 32-36.
360. “Water Gas Shift Reaction on Ni-W-Ce Catalysts: Catalytic Activity and Structural
Characterization”, F. Zhao, Z. Liu, W. Xu, S. Yao, A. Kubacka, A. C. Johnston-Peck, S. D.
Senanayake, A.-Q. Zhang, E.A. Stach, M. Fernández-García, J.A. Rodriguez, J. Phys. Chem. C,
118 (2014) 2528-2538.
361. “Synthesis of ɑ-MoC1-x and β-MoCy Catalysts for CO2 Hydrogenation by Thermal
Carburization of Mo-oxide in Hydrocarbon and Hydrogen Mixtures”, W. Xu, P. J. Ramirez, D.
Stacchiola and J. A. Rodriguez, Catal. Lett., 144 (2014) 1418–1424.
362. “The Bending Machine: CO2 Activation and Hydrogenation on δ-MoC(001) and β-
Mo2C(001) Surfaces”, S. Posada-Pérez, F. Viñes, P. J. Ramirez, A. B. Vidal, J. A. Rodriguez,
and Francesc Illas, Phys. Chem. Chem. Phys., 16 (2014) 14912-14921.
363. “Active Gold-Ceria and Gold-Ceria/Titania Catalysts for CO Oxidation: From
Single-Crystal Model Catalysts to Powder Catalysts”, J. A. Rodriguez, R. Si, J. Evans, W. Xu ,
J. C. Hanson, J. Tao, and Y. Zhu, Catalysis Today, 240 (2015) 229-235.
364. “Unraveling the dynamic nature of a CuO/CeO2 catalyst for CO oxidation in
Operando: A combined study of XANES (Fluorescence) and DRIFTS”, S. Yao, K.
Mudiyanselage, W. Xu, A. Johnston-Peck, J. C. Hanson, T. Wu, D. J. Stacchiola, J. A.
Rodriguez, H. Zhao, K.A. Beyer, K.W. Chapman, P.J. Chupas, A. Martinez-Arias, R. Si, T.B.
Bolin,W. Liu, and S.D. Senanayake, ACS Catalysis, 4 (2014) 1650–1661.
365. “Stabilization of Catalytically Active Cu+ Surface Sites on Titanium–Copper
Mixed-Oxide Films”, A. E. Baber, X. Yang, H.-Y. Kim, K. Mudiyanselage, M. Soldemo, J.
Weissenrieder, S. D. Senanayake, A. Al‐Mahboob, J. T. Sadowski, J. Evans, J.A. Rodriguez, P.
Liu, F. M. Hoffmann, J.G. Chen, and D. J. Stacchiola, Angew. Chemie Int. Ed., 53 (2014) 5336–
5340.
366. “Morphological Effects of the Nanostructured Ceria Support on the Activity and
Stability of CuO/CeO2 Catalysts for the Water-gas Shift Reaction”, S.Y. Yao, W.Q. Xu, A.C.
Johnston-Peck, F.Z. Zhao, Z.Y. Liu, S. Luo, S.D. Senanayake, A. Martínez-Arias, W.J. Liu
and J.A. Rodriguez, Phys. Chem. Chem. Phys., 17 (2014) 17183-17195.
367. “Fundamentals of Methanol Synthesis on Metal Carbide Based Catalysts:
Activation of CO2 and H2”, S. Posada-Perez, F. Viñes, J.A. Rodriguez, and F. Illas, Topics in
Catal., in press (2014).
368. “New Insights on the Structure of C Terminated β-Mo2C(001) Surface from First
Principles Calculations”, G.G. Asara, A. Roldan, J.M. Ricart, J.A. Rodriguez, F. Illas, N.H.
de Leeuw, J. Phys. Chem. C, 118 (2014) 19224-19231.
369. “The Unique Properties of the Metal-Oxide Interface: Reaction of Ethanol on an
Inverse CeOx/Cu(111) Catalyst”, S.D. Senanayake, K. Mudiyanselage, S. Agnoli, J. Hrbek, D.
Stacchiola and J.A. Rodriguez, J. Phys. Chem. C, 118 (2014) 25057–25064.
370. “Highly Active Copper-Ceria and Copper-Ceria-Titania Catalysts for Methanol
Synthesis from CO2”, J. Graciani, K. Mudiyanselage, F. Xu, A. E. Baber, J. Evans, S. D.
Senanayake, D. J. Stacchiola, P. Liu, J. Hrbek, J. F. Sanz and J. A. Rodriguez, Science, 345
(2014) 546-550.
371. “Charge Polarization at a Au-TiC Interface and the Generation of Highly Active and
Selective Catalysts for the Low-Temperature Water Gas Shift Reaction”, J. A. Rodriguez, P. J.
Ramírez, G. G. Asara, F. Viñes, J. Evans, P. Liu, J. M. Ricart, and F. Illas, Angew. Chem. Int.
Ed. 53 (2014) 11270-11274.
372. “Intermediates arising from the Water-Gas Shift Reaction over Cu Surfaces: From
UHV to Near Atmospheric Pressures”, K. Mudiyanselage, S.D. Senanayake, P.J. Ramirez, S.
Kundu, A. Baber, F. Yang, S. Agnoli, S. Axnanda, Z. Liu, J. Hrbek, J. Evans, J.A. Rodriguez,
and D. Stacchiola, Topics in Catalysis, 58 (2015) 271-280.
373. “Pulse Studies to Decipher the Role of Surface Morphology in CuO/CeO2
Nanocatalysts for the Water Gas Shift Reaction”, F. Zhao, Z. Liu, W. Xu, S. Yao, R. Si, A.C.
Johnston-Peck, A. Martinez-Arias, J.C. Hanson, S. Senanayake and J.A. Rodriguez, Catal. Lett.
145 (2015) 808-815.
374. “In Situ and Theoretical Studies for the Dissociation of Water on an Active Ni/CeO2
Catalyst: Importance of Strong Metal-Support Interactions for the Cleavage of O-H bonds”, J.
Carrasco, D. Lopez-Duran, Z. Liu, T. Duchon, J. Evans, S.D. Senanayake, E.J. Crumlin, V.
Matolin, J.A. Rodriguez and M.V. Ganduglia-Pirovano, Angew. Chem. Int. Ed. 54 (2015) 3917-
3921.
375. “Structure and Electronic Properties of Cu Nanoclusters Supported on Mo2C(001)
and MoC(001) Surfaces”, S. Posada-Perez, F. Vines, J.A. Rodriguez and F. Illas, J. Chem. Phys.
143 (2015) 1114704-1,5
376. “Low Pressure CO2 Hydrogenation to Methanol over Gold Nanoparticles Activated
on a CeOx/TiO2 Interface”, X. Yang, S. Kattel, S.D. Senanayake, J.A. Boscoboinik, X. Nie, J.
Graciani, J.A. Rodriguez, P. Liu, D.J. Stacchiola and J.G. Chen, J. Am. Chem. Soc. 137 (2015)
10104-10107.
377. “When Ruthenia Met Titania: Achieving Extraordinary Catalytic Activity at Low
Temperature by Nanostructuring of Oxide”, J. Graciani, F. Yang, A.B. Vidal, D. Stacchiola, J.A.
Rodriguez and J.F. Sanz, Phys. Chem. Chem. Phys. 17 (2015) 26813-26818.
378. “The Carburization of Transition Metal Molybdates (MxMoO4, M= Cu, Ni or Co)
and the Generation of Highly Active Metal/Carbide Catalysts for CO2 Hydrogenation”, W. Xu,
P.J. Ramirez, D. Stacchiola, J.L. Brito and J.A. Rodriguez, Catal. Lett. 145 (2015) 1365-1373.
379. “Exploring the Activity of Au/TiC(001) model Catalysts towards CO and CO2
Hydrogenation”, G.G. Asara, J.M. Ricart, J.A. Rodriguez, F. Illas, Surf. Sci. 640 (2015) 141-
149.
380. “CO Oxidation on Gold-Supported Iron Oxides: New Insights into Strong Oxide-
Metal Interactions”, L. Yu, Y. Liu, F. Yang, J. Evans, J.A. Rodriguez and P. Liu, J. Phys. Chem.
C, 119 (2015) 16614-16622.
381. “Surface-Structure Sensitivity of CeO2 Nanocrystals in Photocatalysis and
Enhancing the Reactivity with Nanogold”, W. Lei, T. Zhang, L. Gu, P. Liu, J.A. Rodriguez,
G. Liu, and M. Liu, ACS Catalysis, 5 (2015) 4385-4393.
382. “Striving Towards Noble-Metal-Free Photocatalytic Water Splitting: The
Hydrogenated-Graphene-TiO2 Prototype”, T.-D. Nguyen-Phan, S. Luo, Z. Liu, A. D.
Gamalski, J. Tao, W. Xu, E.A. Stach, D. E. Polyansky, S. D. Senanayake, E. Fujita and J. A.
Rodriguez, Chemistry of Materials 27 (2015) 6282-6296.
383. “Superior Performance of Ni-W-Ce Mixed-metal Oxide Catalysts for Ethanol Steam
Reforming: Synergistic Effects of W- and Ni-dopants”, Z. Liu, W. Xu, S. Yao, A.C. Johnson-
Peck, F. Zhao, P. Michorczyk, A. Kubacka, E.A. Stach, M. Fernandez-Garcia, S.D. Senanayake
and J.A. Rodriguez, J. Catal. 321 (2015) 90-99.
384. “Hydrogenation of CO2 to Methanol: Importance of Metal-Oxide and Metal-Carbide
Interfaces in the Activation of CO2", J.A. Rodriguez, P. Liu, D. Stacchiola, S. Senanayake, M.
White, and J.G. Chen, ACS Catalysis 5 (2015) 6696-6706.
385. “Direct Epoxidation of Propylene over Stabilized Cu+ Surface Sites on Titanium-
modified Cu2O”, X. Yang, S. Kattel, K. Xiong, K. Mudiyanselage, S. Rykov, S.D. Senanayake,
J.A. Rodriguez, P. Liu, D.J. Stacchiola and J.G. Chen, Angew. Chem. Int. Ed. 54 (2015) 11946-
11951.
386. “Mechanistic Insights of Ethanol Steam reforming over Ni-CeOx(111): The
Importance of Hydroxyl Groups for Suppressing Coke Formation”, Z. Liu, T. Duchon, H. Wang,
E.K. Peterson, Y. Zhou, S. Luo, J. Zhou, V. Mantolin, D.J. Stacchiola, J.A. Rodriguez, and S.
Senanayake, Journal of Physical Chemistry C, 119 (2015) 18248-18256.
387. “Unravelling the Hydrogenation of TiO2 and Graphene Oxide/TiO2 Composites
in Real Time by In Situ Synchrotron X-ray Powder Diffraction and Pair Function Analysis”,
T.-D. Nguyen-Phan, Z. Liu, S. Luo, A. D. Gamalski, D. Vovchok, W. Xu, E. A. Stach, D. E.
Polyansky, E. Fujita, J. A. Rodriguez, and S. D. Senanayake, J. Phys. Chem. C, 120 (2016)
3472-3482.
388. “Formation of β-Mo2C below 600 ºC using MoO2 nanoparticles as precursor”, H.J.
Guzmán, W. Xu, D. Stacchiola, G. Vitale, C.E. Scott, J.A. Rodríguez and P. Pereira-Almao, J.
Catal. 332 (2015) 83-94.
389. “Enhancing the Reactivity of Gold: Nanostructured Au(111) Adsorbs CO”, F.M.
Hoffmann, J. Hrbek, S. Ma, J.B. Park, J.A. Rodriguez, D.J. Stacchiola, and S.D. Senanayake,
Surf. Sci. 650 (2016) 17.
390. “Visible Light-Driven H2 Production over Highly Dispersed Ruthenia on Rutile
TiO2 Nanorods”, T.-D. Nguyen-Phan, S. Luo, D. Vovchok, J. Llorca, J. Graciani, J. Fernández
Sanz, S. Sallis, W. Xu, J. Bai, L. F. J. Piper, D. E. Polyansky, E. Fujita, S. D. Senanayake, D. J.
Stacchiola, and J. A. Rodriguez, ACS Catalysis, 6 (2016) 407-417.
391. "Water-gas Shift Reaction over Gold Nanoparticles Dispersed on Nanostructured
CeOx-TiO2(110) Surfaces: Effects of High Ceria Coverage", D.C. Grinter, J.B. Park, S. Agnoli,
J. Evans, J. Hrbek, D.J. Stacchiola, S.D. Senanayake, and J.A. Rodriguez, Surf. Sci. 650 (2016)
34.
392. “Elucidating the Interaction between Ni and CeOx in Ethanol Steam Reforming
Catalysts: A Perspective of Recent Studies over Model and Powder Systems”, Z. Liu, S.D.
Senanayake and J.A. Rodriguez, Applied Catal. B: Environmental, 197 (2016) 184 (Invited).
393. “Interfacial Cu+ Promoted Surface Reactivity: Carbon Monoxide Oxidation
Reaction over Polycrystalline Copper-Titania Catalysts”, S.D. Senanayake, N. A. Pappoe, T.-D.
Nguyen-Phan, S. Luo, Y. Li, W. Xu, Z. Liu, K. Mudiyanselage, A. Johnston-Peck, A. I. Frenkel,
I. Heckler, D. Stacchiola, and J. A. Rodriguez, Surf. Sci. 652 (2016) 206.
394. “Hydrogenation of CO2 to Methanol on CeOx/Cu(111) and ZnO/Cu(111) Catalysts:
Role of the Metal-Oxide Interface and Importance of Ce3+ Sites” S. D. Senanayake, P. J.
Ramírez, I. Waluyo, S. Kundu, K. Mudiyanselage, Z. Liu, Z. Liu, S. Axnanda, D. J. Stacchiola, J.
Evans, and J. A. Rodriguez, J. Phys. Chem. C, 120 (2016) 1778-1784.
395. “The Conversion of CO2 to Methanol on orthorhombic ß-Mo2C and Cu/ß-Mo2C
Catalysts: Mechanism for Admetal-induced Change in the Selectivity and Activity”, S. Posada-
Pérez, P. J. Ramírez, R. A. Gutiérrez, D. J. Stacchiola, F. Viñes, P. Liu, F. Illas and J. A.
Rodriguez, Catalysis Science & Technology, 6 (2016) 6766.
396. “Systematic Theoretical Study of Ethylene Adsorption on δ-MoC(001), TiC(001),
and ZrC(001) Surfaces” C. Jimenez-Orozco, E. Florez, A. Moreno, P. Liu, and J.A. Rodriguez,
The J. Phys.l Chem. C , 120 (2016) 13531.
397. “Dry Reforming of Methane on a Highly-Active Ni-CeO2 Catalyst: Effects of
Metal-Support Interactions on C−H Bond Breaking”, Z. Liu, D.C. Grinter, P. Lustemberg, T.D.
Nguyen-Phan, Y. Zhou, S. Luo, I. Waluyo, E.J. Crumlin, D.J. Stacchiola, J. Zhou, J. Carrasco,
H.F. Busnengo, M.V. Ganduglia-Pirovano, S.D. Senanayake, and J.A. Rodriguez, Angew.
Chem. Int. Ed. 55 (2016)7455.
398. “Virtual Special Issue on Catalysis at the US Department of Energy National
Laboratories”, M. Pruski, A.D. Sadow, I.I. Slowing, C.L. Marshall, P.S Stair, J.A. Rodriguez, A.
Harris, G. Somorjai, J. Biener, P. Matranga, ACS Catalysis 6 (2016) 3227.
399. “Catalytic Chemistry of Oxide Nanostructures”, A. Asthagiri, D.A. Dixon, Z.
Dohnalek, B.D. Kay, J.A. Rodriguez, R. Rousseau, D. Stacchiola, and J.F. Weaver, In Oxide
Materials at the Two Dimensional Limit, First ed.; F. Netzer, A. Fortunelli, A., Eds. Springer
International: New York, 2016; pp 251-280. (Invited)
400. “Ambient pressure XPS and IRRAS investigation of ethanol steam reforming on
Ni- CeO2(111) catalysts: an in situ study of C-C and O-H bond scission”, Z.Y. Liu, T. Duchon,
H.R. Wang, D.C. Grinter, I. Waluyo, J. Zhou, Q. Liu, B. Jeong, E.J. Crumlin, V. Matolin, D.J.
Stacchiola, J.A. Rodriguez, and S.D. Senanayake, Phys. Chem. Chem. Phys 18 (2016) 16621.
401. “How to stabilize highly active Cu+ cations in a mixed-oxide catalyst.” K.
Mudiyanselage, S. Luo, H.Y. Kim, X. Yang, A.E. Baber, F.M. Hoffmann, S.D. Senanayake, J.
A. Rodriguez, J. G. Chen, P. Liu, and D.J. Stacchiola, Catal. Today 263 (2016) 4.
402. “Au and Pt Nanoparticle Supported Catalysts Taylored for H2 Production: From
Models to Powder Catalysts”, T. Nguyen-Phan, A.E. Baber, J.A. Rodriguez, and S.D.
Senanayake, Applied Catalysis A: Gen. 518 (2016) 18.
403. “Cu Deposited on CeOx-Modified TiO2(110): Synergistic Effects at the Metal−
Oxide Interface and the Mechanism of the WGS Reaction”. J.J. Plata, J. Graciani, J. Evans, J.A.
Rodriguez, and J. Fernandez-Sanz, ACS Catal. 6 (2016) 4608.
404. “Highly Active Au/δ-MoC and Cu/δ-MoC Catalysts for the Conversion of CO2:
The Metal/C Ratio as a Key Factor Defining Activity, Selectivity, and Stability”, S. Posada-
Pérez, P.J. Ramírez, J. Evans, F. Viñes, P. Liu, F. Illas, and J.A. Rodriguez, J. A., J. Am.
Chem. Soc. 138 (2016) 8269.
405. "Potassium and Water Co-Adsorption on TiO2(110): OH-Induced Anchoring of
Potassium and the Generation of Single-Site Catalysts", D. Grinter, E.R. Remesal, S. Luo, S.
Senanayake, D. Stacchiola, J. Graciani, J. Fernandez-Sanz, and J.A. Rodriguez, J. Phys. Chem.
Lett. 7 (2016) 3866.
406. “The Low-temperature Conversion of Methane to Methanol on CeOx/Cu2O
Catalysts: Water Controlled Activation of the C-H Bond”, Z. Zuo, P. J. Ramírez, S. Senanayake,
P. Liu and J. A. Rodriguez, J. Am. Chem. Soc. 138 (2016) 13810.
407. “Room Temperature Activation of Methane and Dry Reforming with CO2 on Ni-
CeO2(111) Surfaces: Effect of Ce3+ Sites and Metal-Support Interactions on C-H bond Cleavage”
P. Lustemberg, P. Ramirez, Z. Liu, R. Gutierrez, D. Grinter, J. Carrasco, S. Senanayake, J.
Rodriguez, M.V. Ganduglia-Pirovano, ACS Catal. 6 (2016) 8184.
408. “Adsorption and dissociation of molecular hydrogen on orthorhombic ẞ-Mo2C and
cubic α-MoC(001) surfaces”, S. Posada-Pérez, F. Viñes, R. Valero, J.A. Rodriguez, and F. Illas,
Surf. Sci. 656 (2017) 24.
409. “ Importance of Low Dimensional CeOx Nanostructures in Pt/CeOx–TiO2Catalysts
for the Water–Gas Shift Reaction”, S. Luo, L. Barrio, T.-D. Nguyen-Phan, D. Vovchok, A.C.
Johnston-Peck, W. Xu, E.A. Stach, J.A, Rodriguez and S.D. Senanayake, J. Phys, Chem. C, 121
(2017) 6635.
410. “Acetylene Adsorption on δ-MoC(001), TiC(001) and ZrC(001) Surfaces: A
Comprehensive Periodic DFT Study”, C. Jimenez-Orozco, E. Florez, A. Moreno, P. Liu and J. A.
Rodriguez, Phys. Chem. Chem. Phys. 19 (2017) 1571.
411. “The Conversion of CO2 to Methanol on Orthorhombic β-Mo2C and Cu/β-Mo2C
Catalysts: Mechanism for Admetal Induced Change in the Selectivity and Activity”, S. Posada-
Perez, P.J. Ramirez, R.A. Gutierrez, D.J. Stacchiola, F. Viñes, P. Liu, F. Illas and J.A.
Rodriguez, Catal. Sci. & Technol. 6 (2016) 6766.
412. “Ceria-based Model Catalysts: Fundamental Studies on the Importance of the Metal-
Ceria Interface in CO oxidation, the Water-gas Shift, CO2 Hydrogenation, and Methane and
Alcohol reforming”, J. A. Rodriguez, D. C. Grinter, Z. Liu, R. M. Palomino and S.D.
Senanayake, Chem. Soc. Reviews 46 (2017) 1824. (Invited)
413. “Highly Active Pt/MoC and Pt/TiC Catalysts for the Low-Temperature Water-gas
Shift Reaction: Effects of the Carbide Metal/Carbon Ratio on the Catalyst Performance”, J.A.
Rodriguez, P.J. Ramirez, and R.A. Gutierrez, Catal. Today 289 (2017) 47.
414. “Active Sites for CO2 Hydrogenation to Methanol on Cu/ZnO Catalysts”, S. Kattel,
P. J. Ramirez, J. Chen, J. A. Rodriguez and P. Liu, Science, 355 (2017) 1296.
415. “Water-Gas-Shift over Metal-Free Nanocrystalline Ceria: An Experimental and
Theoretical Study”, C.J. Guild, D. Vovchok, D.A. Kriz, A. Bruix, B. Hammer, J. Llorca, W. Xu,
A. El-Sawy, S. Biswas, J.A. Rodriguez, S.D. Senanayake and S.L. Suib, Chem. Cat. Chem. 9
(2017) 1373.
416. “New In-Situ and Operando Facilities for Catalysis Science at NSLS-II: The
Deployment of Real-Time, Chemical, and Structure-Sensitive X-ray Probes”, R. M. Palomino, E.
Stavitski, I. Waluyo, Y.-C. K. Chen-Wiegart, M. Abeykoon, J. T. Sadowski, J. A. Rodriguez, A.
I. Frenkel and S. D. Senanayake, Synchrotron Radiation News, 30 (2017) 30 (Invited).
417. “Cu Supported on Mesoporous Ceria: Water-gas Shift Activity at Low Cu Loadings
through Metal–Support Interactions”, D. Vovchok, C. J. Guild, J. Llorca, W. Xu, T. Jafari, P.
Toloueinia, D. Kriz, I. Waluyo, R. M. Palomino, J. A. Rodriguez, S. L. Suib and S. D.
Senanayake, Phys. Chem. Chem. Phys. 19 (2017) 17708.
418. “Interfaces in Heterogeneous Catalytic Reactions: Ambient Pressure XPS as a Tool
to Unravel Surface Chemistry”, R.M. Palomino, R. Hamlyn, Z. Liu, D.C. Grinter, I. Waluyo,
J.A. Rodriguez and S.D. Senanayake, J. Electron Spectros. & Related Phen, 221 (2017) 28
(Invited).
419. “Atomic layered Au clusters on α-MoC as catalyst for the low temperature water
gas shift reaction”, S. Yao, X. Zhang, W. Zhou, R. Gao, W. Xu, Y. Ye, L. Lin, X. Wen, P. Liu,
B. Chen, E. Crumlin, J. Guo, Z. Zuo, W. Li, J. Xie, L. Lu, C. J. Kiely, L. Gu, C. Shi, J. A.
Rodriguez, D. Ma, Science, 357 (2017) 389.
420. “Catalysts for the steam reforming of ethanol and other alcohols”, Z. Liu, S.
Senanayake and J.A Rodriguez, in Ethanol: Science and Engineering (Elsevier) - Editors: Angelo
Basile, Adolfo Iulianelli, Nejat T. Veziroglu, April (2017) (invited)
421. “In situ Investigation of Methane Dry Reforming on M-CeO2(111) {M= Co, Ni,
Cu} Surfaces: Metal-Support Interactions and the activation of C-H bonds at Low Temperature”,
Z. Liu, P. Lustemberg, R. A. Gutiérrez, J. J. Carey, R. M. Palomino, M. Vorokhta, D. C. Grinter,
P. J. Ramírez, V. Matolín, M. Nolan, M.V. Ganduglia-Pirovano, S. D. Senanayake and J. A.
Rodriguez, Angew. Chem. Int. Ed. 56 (2017) 13041.
422. “Methanol Steam Reforming over Ni-CeO2 Model and Powder Catalysts: Pathways
to High Stability and Selectivity for H2/CO2 Production” Z. Liu, S. Yao, A. Johnston-Peck, W.
Xu, J. A. Rodriguez, S. D.Senanayake, Catal. Today, (2017) doi.org/10.1016/j.cattod.2017.08.
041
423. “Response to Technical Comment on: Active Sites for CO2 Hydrogenation to
Methanol on Cu/ZnO Catalysts”, S. Kattel, P. J. Ramirez, J. Chen, J. A. Rodriguez and P. Liu,
Science, 357 (2017) DOI: 10.1126/science.aan8210.
424. “Highly active Au/δ-MoC and Au/β-Mo2C catalysts for the Low-temperature Water Gas
Shift Reaction: Effects of the Carbide Metal/Carbon Ratio on the Catalyst Performance”, S. Posada-
Pérez, R. A. Gutiérrez, Z. Zuo, P. J. Ramírez, F. Viñes, P. Liu, F. Illas, and J. A. Rodriguez,
Catal. Sci. Technol. 7 (2017) 5332.
425. “Hydrogenation of CO2 on ZnO/Cu(100) and ZnO/Cu(111) Catalysts: Role of
Copper Structure and Metal-Oxide Interface in Methanol Synthesis”, R.M.Palomino, P.J.
Ramirez, Z. Liu, R. Hamlyn, I. Waluyo, M. Mahapatra, I. Orozco, A. Hunt, J.P. Simonovis, S.D.
Senanayake and J.A. Rodriguez, J. Phys. Chem. B, 122 (2018) 794.
426. “Acetylene and Ethylene Adsorption on a β-Mo2C(100) Surface: A Periodic DFT
Study on the Role of C- and Mo-terminations for Bonding and Hydrogenation Reactions”, C.
Jimenez-Orozco, E. Florez, A. Moreno, P. Liu and J. A. Rodriguez, J. Phys. Chem. C, 121
(2017) 19786.
427. “High Activity of Au/K/TiO2(110) for CO Oxidation: Alkali Enhanced Dispersion
of Au and Bonding of CO”, J.A. Rodriguez, D.C. Grinter, P.J. Ramírez, D. J. Stacchiola1, and
S. Senanayake, J. Phys. Chem. C 122 (2018) 4324.
428. “Imaging the Ordering of a Weakly Adsorbed Two-Dimensional Condensate:
Ambient-Pressure Microscopy and Spectroscopy of CO2 Molecules on Rutile TiO2(110)”,
R. C. E. Hamlyn, M. Mahapatra, D. C. Grinte, F. Xu, S. Luo, R.M. Palomino, S. Kattel, I.
Waluyo, P. Liu, D. J. Stacchiola, S. D. Senanayake, and J. A. Rodriguez, Phys. Chem. Chem.
Phys. 20 (2018) 13122.
429. “Combining Theory and Experiment for Multitechnique Characterization of
Activated CO2 on Transition Metal Carbide (001) Surfaces”, C. Kunkel, F. Viñes, P. J. Ramírez,
J. A. Rodriguez and F. Illas, J. Phys. Chem. C (2018) in press, DOI: 10.1021/acs.jpcc.7b12227.
430. “Characterization of Mesoporous Co/CeO2 Catalysts for the High Temperature
Water-Gas Shift", D. Vovchok, C. Guild, S. Dissanayake, J. Llorca, E. Stavitski, Z. Liu, R.
Palomino, I. Waluyo, Y. Li, A. Frenkel, J.A. Rodriguez, S. Suib, and S. Senanayake, J. Phys.
Chem. C 122 (2018) 8998.
431. “In-situ Elucidation of the Active State of Co-CeO2 Catalysts in the Dry Reforming
of Methane: The Important Role of the Reducible Oxide Support and Interactions with Cobalt",
F. Zhang, Z. Liu, S. Zhang, N. Akter, R. Palomino, D. Vovchok, I. Orozco, D. Salazar, J.A.
Rodriguez, J. Llorca, J. Lee, D.-H. Kim, W. Xu, A. Frenkel, Y. Li, T.J. Kim, and S. Senanayake,
ACS Catal. 8 (2018) 3550.
432. “In-situ Characterization of Cu/CeO2 Nanocatalysts for CO2 Hydrogenation:
Morphological Effects of Nanostructured Ceria on the Catalytic Activity”, L. Lin, S. Yao, Z. Liu,
F. Zang, N. Li, D. Vovchok, A. Martínez-Arias, R. Castañeda, J. Lin, S. D. Senanayake, D. Su,
D. Ma, J. A. Rodriguez, J. Phys. Chem. C 122 (2018) 12934.
433. “Direct Conversion of Methane to Methanol on Ni-Ceria Surfaces: Metal-Support
Interactions and Water-enabled Catalytic Conversion by Site Blocking” P. G. Lustemberg, R. M.
Palomino, R. A. Gutiérrez, D. C. Grinter, M. Vorokhta, Z. Liu, P. J. Ramírez, V. Matolín, M. V.
Ganduglia-Pirovano, S. D. Senanayake, and J. A. Rodriguez, J. Am. Chem. Soc. 140 (2018)
7681.
434. “Hybrid 0D−2D Phosphorene Quantum Dots−Graphitic Carbon Nitride Nanosheets
for Efficient Hydrogen Evolution” W. Lei, Y. Mi, R. Feng, P. Liu, S. Hu, J. Yu, X. Liu, J. A.
Rodriguez, J. Wang, L. Zheng, K. Tang, S. Zhu, G. Liu, and M. Liu, Nano Energy, 50 (2018)
552.
435. “The Behavior of Inverse Oxide/Metal Catalysts: CO Oxidation and Water-gas
Shift Reaction over ZnO/Cu(111) Surfaces”, M. Mahapatra, R.A. Gutierrez, J. Kang, N. Rui, R.
Hamlyn, Z. Liu, I. Orozco, P.J. Ramirez, S.D. Senanayake and J. A. Rodriguez, Surf. Sci. 681
(2019) 116.
436. “Structural and Chemical State of Doped and Impregnated Mesoporous Ni/CeO2
Catalysts for the Water-gas Shift” D. Vovchok, C.J. Guild, J. Llorca, R.M. Palomino, I. Waluyo,
J.A. Rodriguez, S.L. Suib, and S.D. Senanayake, Applied Cat. A: General, 567 (2018) 1.
437. “Reaction of Methane with MOx/CeO2 (M = Fe, Ni, and Cu) Catalysts: In Situ
Studies with Time-Resolved X-Ray Diffraction”, F. Zhang,S. Yao, Z. Liu, R.A. Gutiérrez, D.
Vovchok, J. Cen, W. Xu, P.J. Ramírez, T. Kim, S. Senanayake, and J.A. Rodriguez J. Phys.
Chem. C, 122 (2018) 28739.
438. “Location and Chemical Speciation of Cu in ZSM-5 During the Water-gas shift
Reaction” D. Vovchok, J. Tata, I. Orozco, F. Zhang, R.M. Palomino, W. Xu, L. Harper, S.J.
Khatib, J.A. Rodriguez, and S.D. Senanayake, Catal. Today 323 (2019) 216.
439. “Robust Light-driven H2 Generation by Gallium-Doped Titania Nanoparticles”, S.
Luo, T.D. Nguyen-Phan, D. Vovchok, I. Waluyo, R.M. Palomino, A.D. Gamalski, L. Barrio, W.
Xu, D.E. Polyansky, J.A. Rodriguez, and S.D. Senanayake, Phys, Chem. Chem. Phys. 20 (2018)
2104.
440. “Methane Activation and Conversion on Well-defined Metal-Oxide Surfaces: In-
situ Studies with Synchrotron-based Techniques”, J.A. Rodriguez, F. Zhang, Z. Liu and S.D.
Senanayake, Catalysis Book Series, Vol 31, Royal Society of Chemistry (2019) [Invited]
441. “Novel Manganese-promoted Inverse CeO2/CuO Catalyst: In situ Characterization and
Activity for the Water-gas Shift Reaction”, A. López Cámara, V. Cortés Corberán, A. Martínez-
Arias , L. Barrio, R. Si, J.C. Hanson, and J.A. Rodriguez, Catal. Today, 339 (2019) 24-31.
442. “Growth, Structure and Catalytic Properties of ZnOx Grown on CuOx/Cu(111)
Surfaces”, M. Mahapatra, J. Kang, P. J. Ramírez, R. Hamlyn, N. Rui, Z. Liu, I. Orozco, S. D.
Senanayake, and J. A. Rodriguez, J. Phys. Chem. C, 122 (2018) 26554-26562.
443. “Diversity of Adsorbed Hydrogen on TiC (001) Surface at High Coverages”, J. J.
Piñero, P. J. Ramírez, S. T. Bromley, F. Illas, F. Viñes, and J. A. Rodriguez, J. Phys. Chem. C, 122
(2018) 26554-26562.
444. “Potassium-Promoted Reduction of Cu2O/Cu(111) by CO”, I. Waluyo, K.
Mudiyanselage, F. Xu, W. An, P. Liu, J. Boscoboinik, J.A. Rodriguez, and D. Stacchiola, J. Phys.
Chem. C. J. Phys. Chem. C, 123 (2019) 8057.
445. “Room Temperature Methane Capture and Activation by Ni Clusters Supported on
TiC(001): Effects of Metal-Carbide Interactions on the Cleavage of the C-H Bond”, H. Prats, R.
Gutierrez, J. Piñero, F. Viñes, S. Bromley, P. Ramirez, J.A. Rodriguez and F. Illas, J. Am. Chem.
Soc. 141 (2019) 5303.
446. “Highly Active Ceria Supported Ru Catalyst for the Dry Reforming of Methane: In-
situ Identification of Ruδ+-Ce3+ Interactions for Enhanced Conversion", Z. Liu, F. Zhang, N. Rui, X.
Li, L. Lin, L. Betancourt, D. Su, W. Xu, J. Cen, K. Attenkofer, H. Idriss, J.A. Rodriguez and S.
Senanayake, ACS Catal. 9 (2019) 3349.
447. “Conversion of CO2 on a Highly Active and Stable Cu/FeOx/CeO2 Catalyst: Tuning
Catalytic Performance by Oxide-Oxide Interactions”, L. Lin, S. Yao, N. Rui, L. Han, F. Zhang, C. A.
Gerlak, Z. Liu, J. Cen, L. Song, S.D. Senanayake, and J.A. Rodriguez, Catal. Sci. & Technol. 9
(2019) 3735.
448. “CO, CO2, and H2 Interactions with (0001) and (001) Tungsten Carbide Surfaces:
Importance of Carbon and Metal Sites” A.A. Koverga, E. Florez, L. Dorkis and J.A. Rodriguez, J.
Phys. Chem. C, 123 (2019) 8871.
449. “Exploring Metal-Support Interactions to Immobilize Sub-nm Co Clusters on δ–Mo2N:
A Highly Selective and Stable Catalyst for CO2 Activation.", S. Yao, L. Lin, W. Liao, N. Li, N. Rui,
Z. Liu, J. Cen, F. Zhang, L. Song, D. Su, S. D. Senanayake, P. Liu, D. Ma, J. G. Chen and J. A.
Rodriguez, ACS Catal. 9 (2019) 9087.
450. “Metal Carbide Surfaces as Catalysts for Olefin and Alkyne Conversion: Binding and
Hydrogenation of Ethylidine”, C. Jimenez-Orozco, E. Florez, A. Moreno and J. A. Rodriguez, J.
Phys.: Conf. Ser. 1247 (2019) 012003.
451. “Kinetic Monte Carlo Simulations Unveil Synergic Effects at Work on Bifunctional
Catalysts”, H. Prats, S. Posada-Perez, J.A. Rodriguez, R. Sayos and F. Illas, ACS Catal. 9 (2019)
9117.
452. “Binding and Activation of Ethylene on Tungsten Carbide and Platinum Surfaces”, C.
Jimenez-Orozco, E. Florez, A. Montoya and J.A. Rodriguez, Phys. Chem. Chem. Phys. 21 (2019)
17332.
453. “Hydroxylation of ZnO/Cu(1 1 1) Inverse Catalysts under Ambient Water Vapor and the
Water–gas Shift Reaction”, I. Orozco, E. Huang, R.A. Gutiérrez, Z. Liu, F. Zhang, M. Mahapatra, J.
Kang, H. Kersell, S. Nemsak, P.J. Ramírez, S.D. Senanayake, P. Liu, and J.A. Rodriguez, J. Phys.
D: Applied Physics 52 (2109) 454001.
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