Publikationen - Artikel
2011
372.
S. K. Shaw,
A. Berná,
J. M. Feliu,
R. J. Nichols,
T. Jacob and
D. J. Schiffrin,
"Role of axially coordinated surface sites for electrochemically controlled carbon monoxide adsorption on single crystal copper electrodes",
Physical Chemistry Chemical Physics,
vol. 13,
no. 12,
pp. 5242,
2011.
Royal Society of Chemistry (RSC).
| DOI: | 10.1039/c0cp02064h |
| Datei: | https://doi.org/10.1039%2Fc0cp02064h |
371.
P. Kaghazchi and
T. Jacob,
"Structure of rhenium surfaces in an oxygen environment",
Physical Review B,
vol. 83,
no. 3,
pp. 035417,
Jan.
2011.
American Physical Society (APS).
| DOI: | 10.1103/physrevb.83.035417 |
| Datei: | https://doi.org/10.1103%2Fphysrevb.83.035417 |
370.
E. Favry,
D. Fantauzzi,
J. Anton,
D. S. Su,
T. Jacob and
N. Alonso-Vante,
"Synthesis, electrochemical characterization and molecular dynamics studies of surface segregation of platinum nano-alloy electrocatalysts",
Physical Chemistry Chemical Physics,
vol. 13,
no. 20,
pp. 9201,
2011.
Royal Society of Chemistry (RSC).
| DOI: | 10.1039/c0cp02384a |
| Datei: | https://doi.org/10.1039%2Fc0cp02384a |
369.
D. M. Kolb and
T. Pajkossy,
"The interfacial capacitance of Au(100) in an ionic liquid, 1-butyl-3-methyl-imidazolium hexafluorophosphate",
Electrochem. Comm.,
vol. 13,
pp. 284-286,
2011.
368.
D. M. Kolb and
M. Gnahm,
"The purification of an ionic liquid",
J. Electroanal. Chem.,
vol. 651,
pp. 250-252,
2011.
2010
367.
W. Gao,
J. A. Keith,
J. Anton and
T. Jacob,
"Theoretical Elucidation of the Competitive Electro-oxidation Mechanisms of Formic Acid on Pt(111)",
Journal of the American Chemical Society,
vol. 132,
no. 51,
pp. 18377—18385,
Nov.
2010.
American Chemical Society (ACS).
| DOI: | 10.1021/ja1083317 |
| Datei: | https://doi.org/10.1021%2Fja1083317 |
366.
J. A. Keith and
T. Jacob,
"Theoretical studies of Pd metal deposition on the $\sqrt$3\texttimes$\sqrt$3 4-mercaptopyridine self-assembled monolayer",
Electrochimica Acta,
vol. 55,
no. 27,
pp. 8258—8262,
Nov.
2010.
Elsevier BV.
| DOI: | 10.1016/j.electacta.2010.04.027 |
| Datei: | https://doi.org/10.1016%2Fj.electacta.2010.04.027 |
365.
P. Kaghazchi and
T. Jacob,
"Nitrogen-induced roughening of Re surfaces on the atomic scale",
Physical Review B,
vol. 82,
no. 16,
pp. 165448,
Okt.
2010.
American Physical Society (APS).
| DOI: | 10.1103/physrevb.82.165448 |
| Datei: | https://doi.org/10.1103%2Fphysrevb.82.165448 |
364.
J. A. Keith and
T. Jacob,
"Theoretical Studies of Potential-Dependent and Competing Mechanisms of the Electrocatalytic Oxygen Reduction Reaction on Pt(111)",
Angewandte Chemie International Edition,
vol. 49,
no. 49,
pp. 9521—9525,
Okt.
2010.
Wiley.
| DOI: | 10.1002/anie.201004794 |
| Datei: | https://doi.org/10.1002%2Fanie.201004794 |
363.
J. A. Keith and
T. Jacob,
"Theoretische Untersuchungen zu potentialabhängigen und konkurrierenden Mechanismen der elektrokatalytischen Sauerstoffreduktion an Pt(111)",
Angewandte Chemie,
vol. 122,
no. 49,
pp. 9711—9716,
Okt.
2010.
Wiley.
| DOI: | 10.1002/ange.201004794 |
| Datei: | https://doi.org/10.1002%2Fange.201004794 |
362.
V. Pershina,
A. Borschevsky,
J. Anton and
T. Jacob,
"Theoretical predictions of trends in spectroscopic properties of gold containing dimers of the 6p and 7p elements and their adsorption on gold",
The Journal of Chemical Physics,
vol. 133,
no. 10,
pp. 104304,
Sep.
2010.
AIP Publishing.
| DOI: | 10.1063/1.3476470 |
| Datei: | https://doi.org/10.1063%2F1.3476470 |
361.
J. A. Keith,
G. Jerkiewicz and
T. Jacob,
"Theoretical Investigations of the Oxygen Reduction Reaction on Pt(111)",
ChemPhysChem,
vol. 11,
no. 13,
pp. 2779—2794,
Aug.
2010.
Wiley.
| DOI: | 10.1002/cphc.201000286 |
| Datei: | https://doi.org/10.1002%2Fcphc.201000286 |
360.
W. Chen,
Q. Shen,
R. A. Bartynski,
P. Kaghazchi and
T. Jacob,
"Reduction of NO by CO on Unsupported Ir: Bridging the Materials Gap",
ChemPhysChem,
vol. 11,
no. 12,
pp. 2515—2520,
Jul.
2010.
Wiley.
| DOI: | 10.1002/cphc.201000254 |
| Datei: | https://doi.org/10.1002%2Fcphc.201000254 |
359.
J. A. Keith,
D. Fantauzzi,
T. Jacob and
A. C. T. Duin,
"Reactive forcefield for simulating gold surfaces and nanoparticles",
Physical Review B,
vol. 81,
no. 23,
pp. 235404,
Jun.
2010.
American Physical Society (APS).
| DOI: | 10.1103/physrevb.81.235404 |
| Datei: | https://doi.org/10.1103%2Fphysrevb.81.235404 |
358.
K. Pötting,
W. Schmickler and
T. Jacob,
"Self-Diffusion on Au(100): A Density Functional Theory Study",
ChemPhysChem,
vol. 11,
no. 7,
pp. 1395—1404,
Mai
2010.
Wiley.
| DOI: | 10.1002/cphc.200900807 |
| Datei: | https://doi.org/10.1002%2Fcphc.200900807 |
357.
V. Pershina,
A. Borschevsky,
J. Anton and
T. Jacob,
"Theoretical predictions of trends in spectroscopic properties of homonuclear dimers and volatility of the 7p elements",
The Journal of Chemical Physics,
vol. 132,
no. 19,
pp. 194314,
Mai
2010.
AIP Publishing.
| DOI: | 10.1063/1.3425996 |
| Datei: | https://doi.org/10.1063%2F1.3425996 |
356.
P. Kaghazchi and
T. Jacob,
"Oxygen-induced reconstruction of$łess$mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"$\greater$$łess$mml:mrow$\greater$$łess$mml:mtext$\greater$Re$łess$/mml:mtext$\greater$$łess$mml:mrow$\greater$$łess$mml:mo$\greater$($łess$/mml:mo$\greater$$łess$mml:mrow$\greater$$łess$mml:mn$\greater$10$łess$/mml:mn$\greater$$łess$mml:mover accent="true"$\greater$$łess$mml:mn$\greater$1$łess$/mml:mn$\greater$$łess$mml:mo stretchy="false"$\greater$\textasciimacron$łess$/mml:mo$\greater$$łess$/mml:mover$\greater$$łess$mml:mn$\greater$0$łess$/mml:mn$\greater$$łess$/mml:mrow$\greater$$łess$mml:mo$\greater$)$łess$/mml:mo$\greater$$łess$/mml:mrow$\greater$$łess$/mml:mrow$\greater$$łess$/mml:math$\greater$studied by density functional theory",
Physical Review B,
vol. 81,
no. 7,
Feb.
2010.
American Physical Society (APS).
| DOI: | 10.1103/physrevb.81.075431 |
| Datei: | https://doi.org/10.1103%2Fphysrevb.81.075431 |
355.
T. Jacob and
J. A. Keith,
"Atomic-level elucidation of the initial stages of self-assembled monolayer metallization",
Chem. Eur. J. (Very Important Paper),
vol. 16,
pp. 12381 - 12386,
2010.
| DOI: | 10.1002/chem.201001396 |
| Datei: |  /fileadmin/website_uni_ulm/nawi.inst.080/publikationen/AngewChem_ORR_2010.pdf |
354.
K. Joshi,
A. C. T. Duin and
T. Jacob,
"Development of a ReaxFF description of gold oxides and initial application to cold welding of partially oxidized gold surfaces",
Journal of Materials Chemistry,
vol. 20,
no. 46,
pp. 10431,
2010.
Royal Society of Chemistry (RSC).
| DOI: | 10.1039/c0jm01556c |
| Datei: | https://doi.org/10.1039%2Fc0jm01556c |
353.
D. M. Kolb,
M. Manolova,
J. Gajdzik,
J. Lenz,
H. Natter,
G. -. Kohring,
F. Giffhorn and
R. Hempelmann,
"Enzyme immobilisation on self-organised nanopatterned electrode surfaces",
Phys. Chem. Chem. Phys.,
vol. 12,
pp. 12604-12607,
2010.
352.
D. M. Kolb,
H. -. Boyen,
M. Metzler,
F. Eberle,
M. Saitner and
P. Wagner,
"Metallization of ultra-thin, non-thiol SAMs with flat-lying molecular units:
Pd on 1,4-dicyanobenzene
",
ChemPhysChem.,
vol. 11,
pp. 2114-2117,
2010.
351.
P. Kaghazchi,
D. Fantauzzi,
J. Anton and
T. Jacob,
"Nanoscale-faceting of metal surfaces induced by adsorbates",
Physical Chemistry Chemical Physics,
vol. 12,
no. 31,
pp. 8669,
2010.
Royal Society of Chemistry (RSC).
| DOI: | 10.1039/c000766h |
| Datei: | https://doi.org/10.1039%2Fc000766h |
350.
T. Jacob,
J. Anton,
W. Gao and
J. A. Keith,
"Oxidation of Formic Acid on Pt(111) surface in gas phase",
Dalton Trans. (special issue),
vol. 39,
pp. 8450-8456,
2010.
| DOI: | 10.1039/C0DT00404A |
| Datei: | /fileadmin/website_uni_ulm/nawi.inst.080/publikationen/DaltonTrans_39_8450_2010.pdf |
349.
T. Jacob and
P. Kaghazchi,
"Oxygen-Induced Reconstruction of Re(1010) studied by Density Functional Theory",
Phys. Rev. B,
vol. 81(7),
pp. 075431,
2010.
| DOI: | 10.1103/physrevb.81.075431 |
| Datei: | /fileadmin/website_uni_ulm/nawi.inst.080/publikationen/PhysRevB_81_075431_2010.pdf |
348.
T. Jacob,
W. Schmickler and
K. Pötting,
"Self-Diffusion on Au(100) - A Density Functional Theory Study",
Chem. Phys. Chem. (special issue),
vol. 11,
pp. 1395-1404,
2010.
| DOI: | 10.1002/cphc.200900807 |
| Datei: | /fileadmin/website_uni_ulm/nawi.inst.080/publikationen/CPC_Au_diffusion_2010.pdf |