2010 - 2014

63. “Catalysis beyond frontier molecular orbitals: Origin of selectivity in partial hydrogenation of multi-unsaturated hydrocarbons on Pd catalysts”
Wei Liu, Karl-Heinz Dostert, Aditya Savara, Casey P. O'Brien, Wiebke Riedel, Swetlana Schauermann*, Alexandre Tkatchenko*
submitted to Science

62. “Interaction of Isophorone with Pd(111): A Combination of IRAS, NEXAFS and DFT Studies
Karl-Heinz Dostert, Casey P. O’Brien, Wiebke Riedel, Aditya A. Savara, Wei Liu, Martin Oehzelt, Alexandre Tkatchenko, Swetlana Schauermann*,
J.Phys. Chem. C, 118 (2014) 27833-27842.
DOI: 10.1021/jp506637v

61. “Single Crystal Adsorption Calorimetry on Well-Defined Surfaces: from Single Crystals to supported Nanoparticles”
S. Schauermann*, T. L. Silbaugh, C.T. Campbell* (invited, personal account),
The Chemical Record, 14 (2014) 759–774.
DOI: 10.1002/tcr.201402022

60. “A Fresh Look at an Old Nano-Technology: Catalysis”
H.-J. Freund, N. Nilius, Th. Risse, S. Schauermann,
Phys.Chem.Chem.Phys., 16 (2014), 8148-8167
DOI: 10.1039/c3cp55231d

59. “How Absorbed Hydrogen Affects Catalytic Activity of Transition Metals”
H. A. Aleksandrov, S. M. Kozlov, S. Schauermann, G. Vayssilov, K. M. Neyman,
Angewandte Chemie Int. Edit. 53 (2014) 13371-5.
DOI: 10.1002/anie.201405738

58. “Model Studies on Heterogeneous Catalysts at the Atomic Scale: From Supported Metal Particles to Two-dimensional Zeolites”
H.-J. Freund, M. Heyde, N. Nilius, S. Schauermann, S. Shaikhutdinov,
J. Catal. 308 (2013) 154–167.
DOI: 10.1016/j.jcat.2013.06.007

57. “Energetics of elementary reaction steps relevant for CO oxidation: CO and O2 adsorption on model Pd nanoparticles and Pd(111)“ , (Advance Article, invited)
M. Peter, S. Adamovsky, J. M. Flores Camacho, S. Schauermann*,
Faraday Disscuss. 162 (2013) 341-354.
DOI: 10.1039/c3fd00001j

56. “Trends in der Bindungsstärke von Oberflächenspezies auf Nanopartikeln: Wie verändert sich die Adsorptionsenergie mit der Partikelgröße?”
M. Peter, J. M. Flores Camacho, S. Adamovski, L.K. Ono, K.-H. Dostert, C.P. O’Brien, B. Roldan Cuenya, S. Schauermann,* H.-J. Freund,
Angew. Chem. 125 (2013) 5282–5287.
DOI: 10.1002/ange.201209476

55. “Trends in binding strength of surface species on nanoparticles: how does the adsorption energy scale with the particle size?“
M. Peter, J. M. Flores Camacho, S. Adamovski, L.K. Ono, K.-H. Dostert, C.P. O’Brien, B. Roldan Cuenya, S. Schauermann,* H.-J. Freund,
Angew. Chem. Int. Ed. 52 (2013) 5175-5179.
DOI: 10.1002/anie.201209476

54. “Temperature dependence of the 2-butene hydrogenation over supported Pd nanoparticles and Pd(111)“
A. Savara, W. Ludwig, K.-H. Dostert, S. Schauermann*,
J. Mol. Catal. 377 (2013) 137– 142.
DOI: 10.1016/j.molcata.2013.04.015

53. “Nanoparticles for Heterogeneous Catalysis: New Mechanistic Insights“ (invited),
S. Schauermann, N. Nilius, S. Shaikhutdinov, H.-J. Freund,
Account on Chemical Research, 46 (2013) 1673–1681.
DOI: 10.1021/ar300225s

52. “Tuning the Surface Chemistry of Pd by Atomic C and H: A Microscopic Picture“
H.A. Aleksandrov, F. Viñes, W. Ludwig, S. Schauermann, K.M. Neyman*,
Chemistry – A European Journal, 19 (2013) 1335-1345.
DOI: 10.1002/chem.201201106

51. “Size-Dependence of the Adsorption Energy of CO on Metal Nanoparticles: A DFT Search for the Minimum Value“
I.V. Yudanov, A. Genest, S. Schauermann, H.-J. Freund, N. Rösch*,
Nano Lett., 12 (2012) 2134-2139.
DOI: 10.1021/nl300515z

50. “Kinetic Evidence for a Non-Langmuir Hinshelwood Surface Reaction: H/D Exchange over Pd Nanoparticles and Pd(111)“
A. Savara, W. Ludwig, S. Schauermann*,
Chem. Phys. Chem. 14 (8) (2013), 1686-1695.
DOI: 10.1002/cphc.201300179

49. “Towards Low-temperature Dehydrogenation Catalysis: Isophorone on Pd(111)“
W. Liu, A. Savara, X. Ren, W. Ludwig, K.-H. Dostert, S. Schauermann*, A. Tkatchenko*, H.-J. Freund, M. Scheffler,
J. Phys. Chem. Lett., 3 (2012) 582-586.
DOI: 10.1021/jz300117g

48. “Olefin Hydrogenation on Pd Model Supported Catalysts: New Mechanistic Insights“, (invited for a special issue “Molecular Approaches in Catalysis“ of J. Catal.)
W. Ludwig, A. Savara, K.-H. Dostert, S. Schauermann*,
J. Catal., 284 (2011) 148-156.
DOI: 10.1016/j.jcat.2011.10.010

47. “Adsorption energetics of CO on supported Pd nanoparticles as a function of particle size by single crystal microcalorimetry“
J. M. Flores-Camacho, J.-H. Fischer-Wolfarth, J. A. Farmer, C. T. Campbell, S. Schauermann*, H.-J. Freund,
Phys. Chem. Chem. Phys., 13 (2011) 16800-16810.
DOI: 10.1039/c1cp21677e

46. “Subsurface Hydrogen Diffusion into Pd nanoparticles: Role of Low-Coordinated Surface Sites and Facilitation by Carbon“
W. Ludwig, A. Savara, R. J. Madix, S. Schauermann*, H.-J. Freund,
J. Phys. Chem. C, 116 (2012) 3539-3544.
DOI: 10.1021/jp209033s

45. “Morphological and chemical influences on alumina-supported palladium catalysts active for the gas phase hydrogenation of crotonaldehyde“
A.R. McInroy, A. Uhl, T. Lear, C. Milroy, T. Klapötke, S. Shaikhutdinov, S. Schauermann, G. Rupprechter, H.-J. Freund, D. Lennon,
J. Chem. Phys., 134 (2011) 214704.
DOI: 10.1063/1.3593472

44. “Innovative Measurement Techniques in Surface Science“
H.-J. Freund, N. Nilius, T. Risse, S. Schauermann, T. Schmidt,
Chem. Phys. Chem., 12 (2011) 79-87.
DOI: 10.1002/cphc.201000812

43. “Model Studies in Catalysis“
N. Nilius T. Risse, S. Schauermann, S. Shaikhutdinov, M. Sterrer, H.-J. Freund,
Top. Catal., 54 (2011) 4-12.
DOI: 10.1007/s11244-011-9626-9

42. “An improved single crystal adsorption calorimeter for determining gas adsorption and reaction energies on complex model catalysts“
J.-H. Fischer, J. Hartmann, J.A. Farmer, J.M. Flores-Camacho, C.T. Campbell, S. Schauermann*, H.-J. Freund,
Rev. Sci. Inst., 82 (2011) 024102.
DOI 10.1063/1.3544020

41. “A Kinetic study on the conversion of cis-2-butene with deuterium on a Pd/Fe3O4 model catalyst“
W. Ludwig, B. Brandt, A. Savara, S. Schauermann*,
Phys. Chem. Chem. Phys., 13 (2011) 966-977.
DOI: 10.1039/c0cp00078g

40. “Role of low-coordinated surface sites in olefin hydrogenation: a molecular beam study on Pd nanoparticles and Pd(111)“
W. Ludwig, A. Savara, S. Schauermann*, H.-J. Freund,
Chem. Phys. Chem., 11 (2010), 2319-2322.
DOI: 10.1002/cphc.201000355

39. “Particle Size Dependent Heats of Adsorption of CO on Supported Pd Nanoparticles as Measured with a Single Crystal Microcalorimeter“
J.-H. Fischer-Wolfarth, J.A. Farmer, J.M. Flores-Camacho, A. Genest, I.V. Yudanov, N. Rösch, C.T. Campbell, S. Schauermann*, H.-J. Freund,
Phys. Rev. B, Rapid Communication, 81 (2010) 241416(R).
DOI: 10.1103/PhysRevB.81.241416

38. “Role of hydrogen in olefin isomerization and hydrogenation: a molecular beam study on Pd model supported catalysts“ (invited)
W. Ludwig, A. Savara, S. Schauermann*,
Dalton Trans., 39 (2010) 8484-8491.
DOI: 10.1039/c003133j

37. “Diffusion von Wasserstoff in Pd Nanopartikeln: Entscheidende Begünstigung durch Kohlenstoff“
K.M. Neyman*, S. Schauermann*,
Angew. Chem., 122 (2010) 4851-4854.
DOI: 10.1002/ange.200904688

36. “Hydrogen Diffusion into Pd Nanoparticles: Promotion by Carbon“
K.M. Neyman*, S. Schauermann*,
Angew. Chem. Int. Ed., 49 (2010) 4743-4746.
DOI: 10.1002/anie.200904688