2008
351.
Jacob,
T.;
Kaghazchi,
P.;
Simeone,
F. C.;
Soliman,
K. A.;
Kibler,
L.A.
Bridging the Gap between Nanoparticles and Single-Crystal Surfaces
Faraday Diss., 140 :69-80
2008
Bridging the Gap between Nanoparticles and Single-Crystal Surfaces
Faraday Diss., 140 :69-80
2008
| DOI: | 10.1039/B802919A |
| File: |  /fileadmin/website_uni_ulm/nawi.inst.080/publikationen/FD140_rev.pdf |
350.
Jacob,
T.;
Wiltner,
A.;
Linsmeier,
C.
Carbon reaction and diffusion on Ni(111), Ni(100), and Fe(110): Kinetic parameters from XPS and DFT analysis
J. Chem. Phys., 129 :084704
2008
Carbon reaction and diffusion on Ni(111), Ni(100), and Fe(110): Kinetic parameters from XPS and DFT analysis
J. Chem. Phys., 129 :084704
2008
| DOI: | 10.1063/1.2971177 |
| File: | /fileadmin/website_uni_ulm/nawi.inst.080/publikationen/JCP_129_084704_2008.pdf |
349.
Jacob,
T.;
Ermanoski,
I.;
Madey,
T.E.;
Kaghazchi,
P.;
Wang,
H.
First Principle Studies on Oxygen-Induced Faceting of Ir(210)
ACS Nano, 2 :1280-1288
2008
First Principle Studies on Oxygen-Induced Faceting of Ir(210)
ACS Nano, 2 :1280-1288
2008
| DOI: | 10.1021/nn800210v |
| File: | /fileadmin/website_uni_ulm/nawi.inst.080/publikationen/ACS_Nano_2_1280_2008.pdf |
348.
Jacob,
T.;
Anton,
J.;
Pershina,
V.
Fully-relativistic DFT Calculations of the Electronic Structures of MO4 (M=Ru, Os, and Element 108, Hs) and Prediction of Physisorption
Phys. Rev. A, 78 :032518
2008
Fully-relativistic DFT Calculations of the Electronic Structures of MO4 (M=Ru, Os, and Element 108, Hs) and Prediction of Physisorption
Phys. Rev. A, 78 :032518
2008
| DOI: | 10.1103/PhysRevA.78.032518 |
| File: | /fileadmin/website_uni_ulm/nawi.inst.080/publikationen/PRA_78_032518_2008.pdf |
347.
Kolb,
D. M.;
Zegenhagen,
J.;
Renner,
F.U.;
Lee,
T.L.;
Stierle,
A.;
Dosch,
H.
In situ x-ray diffraction study of the initial dealloying and passivation of Cu3Au(111) during anodic dissolution
Phys. Rev. B, 77 :235433-235442
2008
In situ x-ray diffraction study of the initial dealloying and passivation of Cu3Au(111) during anodic dissolution
Phys. Rev. B, 77 :235433-235442
2008
346.
Sanz-Navarro,
Carlos F.;
Åstrand,
Per-Olof;
Chen,
De;
Rønning,
Magnus;
Duin,
Adri C. T.;
Jacob,
Timo;
Goddard,
William A.
Molecular Dynamics Simulations of the Interactions between Platinum Clusters and Carbon Platelets
The Journal of Physical Chemistry A, 112 (7) :1392—1402
January 2008
Publisher: American Chemical Society (ACS)
Molecular Dynamics Simulations of the Interactions between Platinum Clusters and Carbon Platelets
The Journal of Physical Chemistry A, 112 (7) :1392—1402
January 2008
Publisher: American Chemical Society (ACS)
| DOI: | 10.1021/jp074806y |
| File: | https://doi.org/10.1021%2Fjp074806y |
345.
Madey,
Theodore E.;
Chen,
Wenhua;
Wang,
Hao;
Kaghazchi,
Payam;
Jacob,
Timo
Nanoscale surface chemistry over faceted substrates: structure, reactivity and nanotemplates
Chemical Society Reviews, 37 (10) :2310
2008
Publisher: Royal Society of Chemistry (RSC)
Nanoscale surface chemistry over faceted substrates: structure, reactivity and nanotemplates
Chemical Society Reviews, 37 (10) :2310
2008
Publisher: Royal Society of Chemistry (RSC)
| DOI: | 10.1039/b719551f |
| File: | https://doi.org/10.1039%2Fb719551f |
344.
Kolb,
D. M.;
Schweizer,
M.;
Manolova,
M.
Potential-induced structure transitions in self-assembled monolayers: II. Propanethiol on Au(100)
Surface Sci., 602 :3303-3307
2008
Potential-induced structure transitions in self-assembled monolayers: II. Propanethiol on Au(100)
Surface Sci., 602 :3303-3307
2008
343.
Jacob,
T.;
Lu,
J.-Y.;
Shen,
W.-Z.;
Preut,
H.;
Arndt,
H.-D.;
Keith,
J. A.;
Schürmann,
Markus
Regioselective de-novo synthesis of cyanohydroxypyridines with a concerted cycloaddition mechanism
J. Am. Chem. Soc. (Communication), 130(40) :13219-13221
2008
Regioselective de-novo synthesis of cyanohydroxypyridines with a concerted cycloaddition mechanism
J. Am. Chem. Soc. (Communication), 130(40) :13219-13221
2008
| DOI: | 10.1021/ja804078v |
| File: | /fileadmin/website_uni_ulm/nawi.inst.080/publikationen/Cyanohydroxypyridines_submitted.pdf |
342.
Kolb,
D. M.;
Kibler,
L.A.;
Kramer,
D.;
Smetanin,
M.;
Viswanath,
R.N.;
Beckmann,
D.;
Koch,
T.;
Weissmüller,
J.
Surface stress-charge response of a (111)-textured gold electrode under conditions of weak ion adsorption
Langmuir, 24 :8561-8567
2008
Surface stress-charge response of a (111)-textured gold electrode under conditions of weak ion adsorption
Langmuir, 24 :8561-8567
2008
341.
Kolb,
D. M.;
Tang,
J.;
Wei,
Y-M.;
Zhou,
X-S.;
Wang,
J-G.;
Mao,
B-W.
The creation of nanostructures on a Au(111) electrode by tip-induced iron depositon from an ionic liquid
Small, 9 :1355-1358
2008
The creation of nanostructures on a Au(111) electrode by tip-induced iron depositon from an ionic liquid
Small, 9 :1355-1358
2008
340.
Jacob,
T.;
Piskunov,
S.;
Spohr,
E.;
Kotomin,
E.A.;
Ellis,
D.E.;
Heifets,
E.
The Electronic Structure and Thermodynamic Stability of LaMnO3 and La1-xSrxMnO3 (001) Surfaces: Ab initio Calculations
Phys. Rev. B (Rapid Communication), 121406(R) :78
2008
The Electronic Structure and Thermodynamic Stability of LaMnO3 and La1-xSrxMnO3 (001) Surfaces: Ab initio Calculations
Phys. Rev. B (Rapid Communication), 121406(R) :78
2008
| DOI: | 10.1103/PhysRevB.78.121406 |
| File: | /fileadmin/website_uni_ulm/nawi.inst.080/publikationen/PhysRevB_45_2008.pdf |
339.
Jacob,
T.;
Simeone,
F. C.;
Kolb,
D. M.;
Venkatachalam,
S.
Tunneling Behaviour of Electrified Interfaces
Surf. Sci., 7 :1401-1407
2008
Tunneling Behaviour of Electrified Interfaces
Surf. Sci., 7 :1401-1407
2008
| DOI: | 10.1016/j.susc.2008.01.034 |
| File: | /fileadmin/website_uni_ulm/nawi.inst.080/publikationen/SurfSci_7_1401_2008.pdf |
338.
Kolb,
D. M.;
Kibler,
L.A.;
Pluntke,
Y.
Unique activity of Pd monomers: hydrogen evolution at AuPd(111) surface alloys
Phys. Chem. Chem. Phys., 10 :3684-3688
2008
Unique activity of Pd monomers: hydrogen evolution at AuPd(111) surface alloys
Phys. Chem. Chem. Phys., 10 :3684-3688
2008
2007
337.
Kaghazchi,
P.;
Jacob,
T.
First-principles studies on clean and oxygen-adsorbed Ir(110) surfaces
Physical Review B, 76 (24)
December 2007
Publisher: American Physical Society (APS)
First-principles studies on clean and oxygen-adsorbed Ir(110) surfaces
Physical Review B, 76 (24)
December 2007
Publisher: American Physical Society (APS)
| DOI: | 10.1103/physrevb.76.245425 |
| File: | https://doi.org/10.1103%2Fphysrevb.76.245425 |
336.
Simeone,
Felice\hspace0.25emC.;
Kolb,
Dieter\hspace0.25emM.;
Venkatachalam,
Sudha;
Jacob,
Timo
Die Au(111)-Elektrolyt-Grenzschicht: eine Tunnelspektroskopie- und DFT-Untersuchung
Angewandte Chemie, 119 (46) :9061—9064
November 2007
Publisher: Wiley
Die Au(111)-Elektrolyt-Grenzschicht: eine Tunnelspektroskopie- und DFT-Untersuchung
Angewandte Chemie, 119 (46) :9061—9064
November 2007
Publisher: Wiley
| DOI: | 10.1002/ange.200702868 |
| File: | https://doi.org/10.1002%2Fange.200702868 |
335.
Wang,
Hao;
Chan,
Ally S. Y.;
Chen,
Wenhua;
Kaghazchi,
Payam;
Jacob,
Timo;
Madey,
Theodore E.
Facet Stability in Oxygen-Induced Nanofaceting of Re(123̅1)
ACS Nano, 1 (5) :449—455
November 2007
Publisher: American Chemical Society (ACS)
Facet Stability in Oxygen-Induced Nanofaceting of Re(123̅1)
ACS Nano, 1 (5) :449—455
November 2007
Publisher: American Chemical Society (ACS)
| DOI: | 10.1021/nn700238r |
| File: | https://doi.org/10.1021%2Fnn700238r |
334.
Simeone,
Felice\hspace0.25emC.;
Kolb,
Dieter\hspace0.25emM.;
Venkatachalam,
Sudha;
Jacob,
Timo
The Au(111)/Electrolyte Interface: A Tunnel-Spectroscopic and DFT Investigation
Angewandte Chemie International Edition, 46 (46) :8903—8906
November 2007
Publisher: Wiley
The Au(111)/Electrolyte Interface: A Tunnel-Spectroscopic and DFT Investigation
Angewandte Chemie International Edition, 46 (46) :8903—8906
November 2007
Publisher: Wiley
| DOI: | 10.1002/anie.200702868 |
| File: | https://doi.org/10.1002%2Fanie.200702868 |
333.
Venkatachalam,
Sudha;
Jacob,
Timo
DFT Studies on the Nature of Coadsorbates on SO$łess$sub$\greater$4$łess$/sub$\greater$ $łess$sup$\greater$2-$łess$/sup$\greater$/Au(111)
Zeitschrift für Physikalische Chemie, 221 (9-10) :1393—1406
October 2007
Publisher: Walter de Gruyter GmbH
DFT Studies on the Nature of Coadsorbates on SO$łess$sub$\greater$4$łess$/sub$\greater$ $łess$sup$\greater$2-$łess$/sup$\greater$/Au(111)
Zeitschrift für Physikalische Chemie, 221 (9-10) :1393—1406
October 2007
Publisher: Walter de Gruyter GmbH
| DOI: | 10.1524/zpch.2007.221.9-10.1393 |
| File: | https://doi.org/10.1524%2Fzpch.2007.221.9-10.1393 |
332.
Jacob,
Timo
Theoretical investigations on the potential-induced formation of Pt-oxide surfaces
Journal of Electroanalytical Chemistry, 607 (1-2) :158—166
September 2007
Publisher: Elsevier BV
Theoretical investigations on the potential-induced formation of Pt-oxide surfaces
Journal of Electroanalytical Chemistry, 607 (1-2) :158—166
September 2007
Publisher: Elsevier BV
| DOI: | 10.1016/j.jelechem.2007.03.023 |
| File: | https://doi.org/10.1016%2Fj.jelechem.2007.03.023 |
331.
Piskunov,
Sergei;
Spohr,
Eckhard;
Jacob,
Timo;
Kotomin,
Eugene A.;
Ellis,
Donald E.
Electronic and magnetic structure of L" display="inline"$\greater$$łess$mml:mrow$\greater$$łess$mml:msub$\greater$$łess$mml:mi mathvariant="normal"$\greater$La$łess$/mml:mi$\greater$$łess$mml:mn$\greater$0.875$łess$/mml:mn$\greater$$łess$/mml:msub$\greater$$łess$mml:msub$\greater$$łess$mml:mi mathvariant="normal"$\greater$Sr$łess$/mml:mi$\greater$$łess$mml:mn$\greater$0.125$łess$/mml:mn$\greater$$łess$/mml:msub$\greater$$łess$mml:mi mathvariant="normal"$\greater$Mn$łess$/mml:mi$\greater$$łess$mml:msub$\greater$$łess$mml:mi mathvariant="normal"$\greater$O$łess$/mml:mi$\greater$$łess$mml:mn$\greater$3$łess$/mml:mn$\greater$$łess$/mml:msub$\greater$$łess$/mml:mrow$\greater$$łess$/mml:math$\greater$calculated by means of hybrid density-functional theory
Physical Review B, 76 (1)
July 2007
Publisher: American Physical Society (APS)
Electronic and magnetic structure of L" display="inline"$\greater$$łess$mml:mrow$\greater$$łess$mml:msub$\greater$$łess$mml:mi mathvariant="normal"$\greater$La$łess$/mml:mi$\greater$$łess$mml:mn$\greater$0.875$łess$/mml:mn$\greater$$łess$/mml:msub$\greater$$łess$mml:msub$\greater$$łess$mml:mi mathvariant="normal"$\greater$Sr$łess$/mml:mi$\greater$$łess$mml:mn$\greater$0.125$łess$/mml:mn$\greater$$łess$/mml:msub$\greater$$łess$mml:mi mathvariant="normal"$\greater$Mn$łess$/mml:mi$\greater$$łess$mml:msub$\greater$$łess$mml:mi mathvariant="normal"$\greater$O$łess$/mml:mi$\greater$$łess$mml:mn$\greater$3$łess$/mml:mn$\greater$$łess$/mml:msub$\greater$$łess$/mml:mrow$\greater$$łess$/mml:math$\greater$calculated by means of hybrid density-functional theory
Physical Review B, 76 (1)
July 2007
Publisher: American Physical Society (APS)
| DOI: | 10.1103/physrevb.76.012410 |
| File: | https://doi.org/10.1103%2Fphysrevb.76.012410 |
330.
Kolb,
D. M.;
Meyer,
H.;
Memmert,
U.;
Täubert,
C.E.
Adsorption of the additives MPA, MPSA and SPS onto Cu(111) from sulphuric acid solutions
J. Electrochem. Soc., 154 :D293-D299
2007
Adsorption of the additives MPA, MPSA and SPS onto Cu(111) from sulphuric acid solutions
J. Electrochem. Soc., 154 :D293-D299
2007
329.
Jacob,
T.;
Venkatachalam,
S.
DFT studies on the nature of coadsorbates on SO 4 2- Au(111)studied with DFT
Z. Phys. Chem., 221 :1393-1406
2007
DFT studies on the nature of coadsorbates on SO 4 2- Au(111)studied with DFT
Z. Phys. Chem., 221 :1393-1406
2007
| DOI: | 10.1524/zpch.2007.221.9–10.1393 |
| File: | /fileadmin/website_uni_ulm/nawi.inst.080/publikationen/Z_Phys_Chem_221_1393_2007.pdf |
328.
Jacob,
T.;
Simeone,
F. C.;
Kolb,
D. M.;
Venkatachalam,
S.
Die Au(111)/Elektrolyt Grenzschicht: Eine Tunnelspektrospoie und DFT Untersuchung
Angew. Chem., 119 :9061-9064
2007
Die Au(111)/Elektrolyt Grenzschicht: Eine Tunnelspektrospoie und DFT Untersuchung
Angew. Chem., 119 :9061-9064
2007
| DOI: | 10.1002/ange.200702868 |
| File: | /fileadmin/website_uni_ulm/nawi.inst.080/publikationen/AngewChem_119_9061_2007.pdf |
327.
Kolb,
D. M.;
Pajkossy,
T.
Double layer capacitance of the platinum group metals in the double layer region
Electrochem. Comm., 9 :1171-1174
2007
Double layer capacitance of the platinum group metals in the double layer region
Electrochem. Comm., 9 :1171-1174
2007