98
5 Adatoms, Defects, and Kink Edges
23. A. Baraldi, L. Bianchettin, E. Vesselli, S. de Gironcoli, S. Lizzit, L. Petaccia, G. Zampieri,
G. Comelli, R. Rosei, Highly under-coordinated atoms at Rh surfaces: interplay of strain and
coordination effects on core level shift. New J. Phys. 9, 143 (2007)
24. L. Bianchettin, A. Baraldi, S. de Gironcoli, E. Vesselli, S. Lizzit, L. Petaccia, G. Comelli, R.
Rosei, Core level shifts of undercoordinated Pt atoms. J. Chem. Phys. 128(11), 114706 (2008)
25. X.B. Zhou, J.L. Erskine, Surface core-level shifts at vicinal tungsten surfaces. Phys. Rev. B
79(15), 155422 (2009)
26. N. Martensson, H.B. Saalfeld, H. Kuhlenbeck, M. Neumann, Structural dependence of the
5d-metal surface energies as deduced from surface core-level shift measurements. Phys. Rev.
B 39(12), 8181–8186 (1989)
27. A.S.Y. Chan, G.K. Wertheim, H. Wang, M.D. Ulrich, J.E. Rowe, T.E. Madey, Surface atom
core-level shifts of clean and oxygen-covered Re(1231). Phys. Rev. B 72(3), 035442 (2005)
28. J. Gustafson, M. Borg, A. Mikkelsen, S. Gorovikov, E. Lundgren, J.N. Andersen, Identification
of step atoms by high resolution core level spectroscopy. Phys. Rev. Lett. 91(5), 056102 (2003)
29. A. Baraldi, S. Lizzit, F. Bondino, G. Comelli, R. Rosei, C. Sbraccia, N. Bonini, S. Baroni,
A. Mikkelsen, J.N. Andersen, Thermal stability of the Rh(110) missing-row reconstruction:
Combination of real-time core-level spectroscopy and ab initio modeling. Phys. Rev. B 72(7),
075417 (2005)
30. J. Sánchez-Royo, J. Pellicer-Porres, A. Segura, S. Gilliland, J. Avila, M. Asensio, O. Safonova,
M. Izquierdo, A. Chevy, Buildup and structure of the In Se/Pt interface studied by angleresolved photoemission and x-ray absorption spectroscopy. Phys. Rev. B 73(15), 155308 (2006)
31. X.J. Liu, M.L. Bo, X. Zhang, L. Li, Y.G. Nie, H. Tian, Y. Sun, S. Xu, Y. Wang, W. Zheng, C.Q.
Sun, Coordination-resolved electron spectrometrics. Chem. Rev. 115(14), 6746–6810 (2015)
32. A. Mellor, D. Humphrey, C.M. Yim, C.L. Pang, H. Idriss, G. Thornton, Direct visualization of
Au Atoms Bound to TiO2 (110) O-Vacancies. J. Phys. Chem. C 121(44), 24721–24725 (2017)
33. Y. Pan, Y. Cui, C. Stiehler, N. Nilius, H.-J. Freund, Gold Adsorption on CeO2 Thin Films
Grown on Ru(0001). J. Phys. Chem. C 117(42), 21879–21885 (2013)
34. T.-Y. Chang, Y. Tanaka, R. Ishikawa, K. Toyoura, K. Matsunaga, Y. Ikuhara, N. Shibata, Direct
imaging of pt single atoms adsorbed on TiO2 (110) surfaces. Nano Lett. 14(1), 134–138 (2013)
35. L.L. Patera, F. Bianchini, C. Africh, C. Dri, G. Soldano, M.M. Mariscal, M. Peressi, G. Comelli,
Real-time imaging of adatom-promoted graphene growth on nickel. Science 359(6381), 1243–
1246 (2018)
36. M. Haruta, Size-and support-dependency in the catalysis of gold. Catal. Today 36(1), 153–166
(1997)
37. D. Matthey, J. Wang, S. Wendt, J. Matthiesen, R. Schaub, E. Lægsgaard, B. Hammer, F. Besenbacher, Enhanced bonding of gold nanoparticles on oxidized TiO 2 (110). Science 315(5819),
1692–1696 (2007)
38. S. Chrétien, H. Metiu, Density functional study of the interaction between small Au clusters,
Au n (n = 1–7) and the rutile TiO 2 surface. II. Adsorption on a partially reduced surface. J.
Chem. Phys. 127(24), 244708 (2007)
39. A. Baraldi, E. Vesselli, L. Bianchettin, G. Comelli, S. Lizzit, L. Petaccia, S. de Gironcoli, A.
Locatelli, T.O. Mentes, L. Aballe, J. Weissenrieder, J.N. Andersen, The (1x1)-> hexagonal
structural transition on Pt(100) studied by high-energy resolution core level photoemission. J.
Chem. Phys. 127(16), 164702 (2007)
40. C.Q. Sun, Y. Wang, Y.G. Nie, Y. Sun, J.S. Pan, L.K. Pan, Z. Sun, Adatoms-induced local bond
contraction, quantum trap depression, and charge polarization at Pt and Rh surfaces. J. Phys.
Chem. C 113(52), 21889–21894 (2009)
41. C.Q. Sun, Size dependence of nanostructures: Impact of bond order deficiency. Prog. Solid
State Chem. 35(1), 1–159 (2007)
42. A.J. Cox, J.G. Louderback, S.E. Apsel, L.A. Bloomfield, Magnetic in 4d-transition metalclusters. Phys. Rev. B 49(17), 12295–12298 (1994)
43. E. Roduner, Size matters: why nanomaterials are different. Chem. Soc. Rev. 35(7), 583–592
(2006)
5 Adatoms, Defects, and Kink Edges
23. A. Baraldi, L. Bianchettin, E. Vesselli, S. de Gironcoli, S. Lizzit, L. Petaccia, G. Zampieri,
G. Comelli, R. Rosei, Highly under-coordinated atoms at Rh surfaces: interplay of strain and
coordination effects on core level shift. New J. Phys. 9, 143 (2007)
24. L. Bianchettin, A. Baraldi, S. de Gironcoli, E. Vesselli, S. Lizzit, L. Petaccia, G. Comelli, R.
Rosei, Core level shifts of undercoordinated Pt atoms. J. Chem. Phys. 128(11), 114706 (2008)
25. X.B. Zhou, J.L. Erskine, Surface core-level shifts at vicinal tungsten surfaces. Phys. Rev. B
79(15), 155422 (2009)
26. N. Martensson, H.B. Saalfeld, H. Kuhlenbeck, M. Neumann, Structural dependence of the
5d-metal surface energies as deduced from surface core-level shift measurements. Phys. Rev.
B 39(12), 8181–8186 (1989)
27. A.S.Y. Chan, G.K. Wertheim, H. Wang, M.D. Ulrich, J.E. Rowe, T.E. Madey, Surface atom
core-level shifts of clean and oxygen-covered Re(1231). Phys. Rev. B 72(3), 035442 (2005)
28. J. Gustafson, M. Borg, A. Mikkelsen, S. Gorovikov, E. Lundgren, J.N. Andersen, Identification
of step atoms by high resolution core level spectroscopy. Phys. Rev. Lett. 91(5), 056102 (2003)
29. A. Baraldi, S. Lizzit, F. Bondino, G. Comelli, R. Rosei, C. Sbraccia, N. Bonini, S. Baroni,
A. Mikkelsen, J.N. Andersen, Thermal stability of the Rh(110) missing-row reconstruction:
Combination of real-time core-level spectroscopy and ab initio modeling. Phys. Rev. B 72(7),
075417 (2005)
30. J. Sánchez-Royo, J. Pellicer-Porres, A. Segura, S. Gilliland, J. Avila, M. Asensio, O. Safonova,
M. Izquierdo, A. Chevy, Buildup and structure of the In Se/Pt interface studied by angleresolved photoemission and x-ray absorption spectroscopy. Phys. Rev. B 73(15), 155308 (2006)
31. X.J. Liu, M.L. Bo, X. Zhang, L. Li, Y.G. Nie, H. Tian, Y. Sun, S. Xu, Y. Wang, W. Zheng, C.Q.
Sun, Coordination-resolved electron spectrometrics. Chem. Rev. 115(14), 6746–6810 (2015)
32. A. Mellor, D. Humphrey, C.M. Yim, C.L. Pang, H. Idriss, G. Thornton, Direct visualization of
Au Atoms Bound to TiO2 (110) O-Vacancies. J. Phys. Chem. C 121(44), 24721–24725 (2017)
33. Y. Pan, Y. Cui, C. Stiehler, N. Nilius, H.-J. Freund, Gold Adsorption on CeO2 Thin Films
Grown on Ru(0001). J. Phys. Chem. C 117(42), 21879–21885 (2013)
34. T.-Y. Chang, Y. Tanaka, R. Ishikawa, K. Toyoura, K. Matsunaga, Y. Ikuhara, N. Shibata, Direct
imaging of pt single atoms adsorbed on TiO2 (110) surfaces. Nano Lett. 14(1), 134–138 (2013)
35. L.L. Patera, F. Bianchini, C. Africh, C. Dri, G. Soldano, M.M. Mariscal, M. Peressi, G. Comelli,
Real-time imaging of adatom-promoted graphene growth on nickel. Science 359(6381), 1243–
1246 (2018)
36. M. Haruta, Size-and support-dependency in the catalysis of gold. Catal. Today 36(1), 153–166
(1997)
37. D. Matthey, J. Wang, S. Wendt, J. Matthiesen, R. Schaub, E. Lægsgaard, B. Hammer, F. Besenbacher, Enhanced bonding of gold nanoparticles on oxidized TiO 2 (110). Science 315(5819),
1692–1696 (2007)
38. S. Chrétien, H. Metiu, Density functional study of the interaction between small Au clusters,
Au n (n = 1–7) and the rutile TiO 2 surface. II. Adsorption on a partially reduced surface. J.
Chem. Phys. 127(24), 244708 (2007)
39. A. Baraldi, E. Vesselli, L. Bianchettin, G. Comelli, S. Lizzit, L. Petaccia, S. de Gironcoli, A.
Locatelli, T.O. Mentes, L. Aballe, J. Weissenrieder, J.N. Andersen, The (1x1)-> hexagonal
structural transition on Pt(100) studied by high-energy resolution core level photoemission. J.
Chem. Phys. 127(16), 164702 (2007)
40. C.Q. Sun, Y. Wang, Y.G. Nie, Y. Sun, J.S. Pan, L.K. Pan, Z. Sun, Adatoms-induced local bond
contraction, quantum trap depression, and charge polarization at Pt and Rh surfaces. J. Phys.
Chem. C 113(52), 21889–21894 (2009)
41. C.Q. Sun, Size dependence of nanostructures: Impact of bond order deficiency. Prog. Solid
State Chem. 35(1), 1–159 (2007)
42. A.J. Cox, J.G. Louderback, S.E. Apsel, L.A. Bloomfield, Magnetic in 4d-transition metalclusters. Phys. Rev. B 49(17), 12295–12298 (1994)
43. E. Roduner, Size matters: why nanomaterials are different. Chem. Soc. Rev. 35(7), 583–592
(2006)