2014

492.
Bartynski, R. A.; Chen, W.; Jacob, T.; Junno, G.; Kaghazchi, P.; Koel, B. E.; Wang, H.; Yang, X.
Theoretical Study of Carbon Adsorption on Re Surfaces: Morphological Instability
Catal Lett, 144 :1667-1673
2014
Publisher: Springer Science and Business Media
DOI:10.1007/s10562-014-1324-3
File:/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0117_Theor_Stud_of_Carbon_on_RE_Surfaces_Catal_Lett_2014.pdf
491.
Müller, Matthias; Choudhury, Soumyadip; Gruber, Katharina; Cruz, Valene B.; Fuchsbichler, Bernd; Jacob, Timo; Koller, Stefan; Stamm, Manfred; Ionov, Leonid; Beckhoff, Burkhard
Sulfur X-ray absorption fine structure in porous Li\textendashS cathode films measured under argon atmospheric conditions
Spectrochimica Acta Part B: Atomic Spectroscopy, 94-95 :22—26
April 2014
Publisher: Elsevier BV
DOI:10.1016/j.sab.2014.03.001
File:https://doi.org/10.1016%2Fj.sab.2014.03.001
490.
Gao, Wang; Song, Er Hong; Jiang, Qing; Jacob, Timo
Revealing the Active Intermediates in the Oxidation of Formic Acid on Au and Pt(111)
Chemistry - A European Journal, 20 (35) :11005—11012
July 2014
Publisher: Wiley
DOI:10.1002/chem.201402737
File:https://doi.org/10.1002%2Fchem.201402737
489.
Jacob, T.; Kolb, D. M.; Soliman, K. A.; Kibler, L.A.
Restructuring of Ir(210) electrode surface by potential cycling
Beilstein J. Nanotechnol., 5 :1349–1356
2014
DOI:10.3762/bjnano.5.148
File:pdf/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0112_Restructuring_of_an_Ir_Beilstein_2014.pdf
488.
Soliman, Khaled A; Kolb, Dieter M; Kibler, Ludwig A; Jacob, Timo
Restructuring of an Ir(210) electrode surface by potential cycling
Beilstein Journal of Nanotechnology, 5 :1349—1356
August 2014
Publisher: Beilstein Institut
DOI:10.3762/bjnano.5.148
File:https://doi.org/10.3762%2Fbjnano.5.148
487.
Zhao-Karger, Zhirong; Mueller, Jonathan E.; Zhao, Xiangyu; Fuhr, Olaf; Jacob, Timo; Fichtner, Maximilian
Novel transmetalation reaction for electrolyte synthesis for rechargeable magnesium batteries
RSC Adv., 4 (51) :26924—26927
2014
Publisher: Royal Society of Chemistry (RSC)
DOI:10.1039/c4ra03867c
File:https://doi.org/10.1039%2Fc4ra03867c
486.
Wang, Hao; Chen, Wenhua; Bartynski, Robert A.; Kaghazchi, Payam; Jacob, Timo
Nitrogen-induced reconstruction and faceting of Re(112\textasciimacron1)
The Journal of Chemical Physics, 140 (2) :024707
January 2014
Publisher: AIP Publishing
DOI:10.1063/1.4861046
File:https://doi.org/10.1063%2F1.4861046
485.
Jacob, T.; Müller, M.; Choudhury, S.; Gruber, K.; Cruz, V. B.; Fuchsbichler, B.; Koller, S.; Stamm, M.; Ionov, L.; Beckhoff, B.
Sulfur X-ray absorption fine structure in porous Li-S cathode films measured under argon atmospheric conditions
Spectrochim. Acta Part B, 94–95 :22–26
2014
DOI:10.1016/j.sab.2014.03.001
File:pdf/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0109_Sulfur_X_ray_absorption_J_Spectrochim_ActaPartB_2014.pdf
484.
Harms, C.; Adam, M.; Soliman, K. A.; Wilhelm, M.; Kibler, L. A.; Jacob, T.; Grathwohl, G.
New Electrocatalysts with Pyrolyzed Siloxane Matrix
Electrocatalysis, 5 (3) :301—309
April 2014
Publisher: Springer Science and Business Media LLC
DOI:10.1007/s12678-014-0190-5
File:https://doi.org/10.1007%2Fs12678-014-0190-5
483.
Saba, Lehel; Jacob, Timo
Grundlagen elektrochemischer Grenzschichten
Bunsen-Magazin, 6 :260—267
June 2014
Publisher: Deutsche Bunsen-Gesellschaft
ISSN: 1611-9479
482.
Dai, Y.; Metzler, M.; Jacob, T.; Kolb, D.M.; Ziener, U.
Fast vs. Slow: Electrolyte and Potential Dependent Adlayer Switching of an Oligopyridine on Au(111)
Electrochimica Acta, 137 :416—422
August 2014
Publisher: Elsevier BV
DOI:10.1016/j.electacta.2014.06.046
File:https://doi.org/10.1016%2Fj.electacta.2014.06.046
481.
Andriyevsky, Bohdan; Doll, Klaus; Jacob, Timo
Electronic and transport properties of LiCoO$łess$sub$\greater$2$łess$/sub$\greater$
Phys. Chem. Chem. Phys., 16 (42) :23412—23420
2014
Publisher: Royal Society of Chemistry (RSC)
DOI:10.1039/c4cp03052d
File:https://doi.org/10.1039%2Fc4cp03052d
480.
Exner, K. S.; Over, H.
Controlling Selectivity in the Chlorine Evolution Reaction over RuO2-based Catalysts
Angew. Chemie Int. Ed. (53) :11032 - 11035
2014
Publisher: Wiley -VCH
DOI:10.1002/anie.201406112
File:/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0116e_Controlling_Selectivity_Angew_Chem_2014.pdf
479.
Jacob, T.; Keith, J. A.
A Guidebook Through the Zoo of First Principles Calculations on Oxygen Reduction
Chem. Rev.
2014
478.
Exner, K. S.
Controlling Selectivity in the Chlorine Evolution Reaction over RuO2-based Catalysts
Angew. Chemie (126) :11212 - 11215
2014
Publisher: Wiley-VCH
DOI:10.1002/ange.201406112
File:/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0116d_Controlling_Selectivity_Angew_Chem_2014.pdf
477.
Jacob, T.; Anton, J.; Exner, K. S.; Over, H.
Chlorine Evolution Reaction on RuO2(110): Ab initio Atomistic Thermodynamics Study – Pourbaix Diagrams
Electrochim. Acta, 120 :460–466
2014
DOI:10.1016/j.electacta.2013.11.027
File:pdf/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0107_Chlorine_Evolution_Electrochimica_Acta_2014.pdf
476.
Jacob, T.; Kibler, L.A.; Mueller, J. E.; Krtil, P.
Bimetallic Alloys in Action: Dynamic Atomistic Motifs for Electrochemistry and Catalysis
Phys. Chem. Chem. Phys., 16 :15029–15042
2014
DOI:10.1039/C4CP01591F
File:pdf/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0114_Bimetallic_Alloys_in_action_PhysChemChemPhys_2014.pdf
475.
Völker, Edgar; Williams, Federico J.; Jacob, Timo; Schiffrin, David J.
ARXPS and DFT studies of thermally induced Pb surface segregation on Au/Cu alloys
Journal of Alloys and Compounds, 586 :475—478
February 2014
Publisher: Elsevier BV
DOI:10.1016/j.jallcom.2013.10.119
File:https://doi.org/10.1016%2Fj.jallcom.2013.10.119
474.
Wei, Wei; Jacob, Timo
Many-body effects in semiconducting single-wall silicon nanotubes
Beilstein Journal of Nanotechnology, 5 :19—25
January 2014
Publisher: Beilstein Institut
DOI:10.3762/bjnano.5.2
File:https://doi.org/10.3762%2Fbjnano.5.2

2013

473.
Wei, W.; Jacob, T.
Strong excitonic effects in the optical properties of graphitic carbon nitride g-C3N4 from first principles
Phys. Rev. B (Editor’s suggestion), 87 :085202
2013
DOI:10.1103/PhysRevB.87.085202
File:pdf/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0094_Strong_Excitonic_Effects_PhysRevB_2013.pdf
472.
Chen, Wenhua; Shen, Quantong; Bartynski, Robert A.; Kaghazchi, Payam; Jacob, Timo
Reduction of Nitric Oxide by Acetylene on Ir Surfaces with Different Morphologies: Comparison with Reduction of NO by CO
Langmuir, 29 (4) :1113—1121
January 2013
Publisher: American Chemical Society (ACS)
DOI:10.1021/la3043878
File:https://doi.org/10.1021%2Fla3043878
471.
Köntje, C.; Kolb, D. M.; Jerkiewicz, G.
Roughening and Long-Range Nanopatterning of Au(111) through Potential Cycling in Aqueous Acidic Media
Langmuir, 29 :10272-10278
2013
470.
Zhu, Tianwei; Hensen, Emiel J. M.; Santen, Rutger A.; Tian, Na; Sun, Shi-Gang; Kaghazchi, Payam; Jacob, Timo
Roughening of Pt nanoparticles induced by surface-oxide formation
Physical Chemistry Chemical Physics, 15 (7) :2268
2013
Publisher: Royal Society of Chemistry (RSC)
DOI:10.1039/c2cp44252c
File:https://doi.org/10.1039%2Fc2cp44252c
469.
Okube, Maki; Petrykin, Valery; Mueller, Jonathan E.; Fantauzzi, Donato; Krtil, Petr; Jacob, Timo
Topologically Sensitive Surface Segregations of Au-Pd Alloys in Electrocatalytic Hydrogen Evolution
ChemElectroChem, 1 (1) :207—212
December 2013
Publisher: Wiley
DOI:10.1002/celc.201300112
File:https://doi.org/10.1002%2Fcelc.201300112
468.
Wei, Wei; Jacob, Timo
Strong excitonic effects in the optical properties of graphitic carbon nitride$łess$mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"$\greater$$łess$mml:mi$\greater$g$łess$/mml:mi$\greater$$łess$/mml:math$\greater$-C$łess$mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"$\greater$$łess$mml:msub$\greater$$łess$mml:mrow /$\greater$$łess$mml:mn$\greater$3$łess$/mml:mn$\greater$$łess$/mml:msub$\greater$$łess$/mml:math$\greater$N$łess$mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"$\greater$$łess$mml:msub$\greater$$łess$mml:mrow /$\greater$$łess$mml:mn$\greater$4$łess$/mml:mn$\greater$$łess$/mml:msub$\greater$$łess$/mml:math$\greater$from first principles
Physical Review B, 87 (8)
February 2013
Publisher: American Physical Society (APS)
DOI:10.1103/physrevb.87.085202
File:https://doi.org/10.1103%2Fphysrevb.87.085202