Publications - Articles
2023
607.
M. Uhl,
T. Geng,
P. A. Schuster,
B. W. Schick,
M. Kruck,
A. Fuoss,
A. J. C. Kuehne and
T. Jacob,
"Kombination von Deep Eutectic Solvents mit TEMPO-basierten Polymerelektroden: Einfluss des Molaren Verhältnisses auf das Elektrodenverhalten",
Angewandte Chemie,
vol. 135,
no. 2,
2023.
Wiley.
| DOI: | 10.1002/ange.202214927 |
| File: | https://doi.org/10.1002%2Fange.202214927 |
606.
M. M. Elnagar,
L. A. Kibler and
T. Jacob,
"Metal deposition and electrocatalysis for elucidating structural changes of gold electrodes during cathodic corrosion",
Green Chemistry,
vol. 25,
no. 16,
pp. 6238–6252,
2023.
Royal Society of Chemistry (RSC).
| DOI: | 10.1039/d3gc01614e |
| File: | http://dx.doi.org/10.1039/D3GC01614E |
605.
B. Kirchhoff,
E. Ö. Jónsson,
T. Jacob and
H. Jónsson,
"On the Challenge of Obtaining an Accurate Solvation Energy Estimate in Simulations of Electro- catalysis",
Top.Catal.,
vol. 66,
pp. 1244-1259,
2023.
Springer.
| DOI: | 10.1007/s11244-023-01829-0 |
604.
L. Braunwarth,
C. Jung and
T. Jacob,
"Potential‐Dependent Pt(111)/Water Interface: Tackling the Challenge of a Consistent Treatment of Electrochemical Interfaces",
ChemPhysChem,
vol. 24,
no. 1,
2023.
Wiley.
| DOI: | 10.1002/cphc.202200336 |
| File: | http://dx.doi.org/10.1002/cphc.202200336 |
603.
C. Im,
B. Kirchhoff,
I. Krivtsov,
D. Mitoraj,
R. Beranek and
T. Jacob,
"Structure and Optical Properties of Polymeric Carbon Nitrides from Atomistic Simulations",
Chemistry of Materials,
vol. 35,
no. 4,
pp. 1547–1559,
Feb.
2023.
American Chemical Society (ACS).
| DOI: | 10.1021/acs.chemmater.2c02843 |
| File: | http://dx.doi.org/10.1021/acs.chemmater.2c02843 |
602.
K. L. Varvaris,
D. Esau,
F. M. Schuett,
T. Jacob and
G. Jerkiewicz,
"Surface Structure Dependence of Electrochemical Processes at Monocrystalline Nickel Electrodes. Part 1: The Hydrogen Evolution Reaction",
The Journal of Physical Chemistry C,
vol. 127,
no. 30,
pp. 14711–14722,
Jul.
2023.
American Chemical Society (ACS).
| DOI: | 10.1021/acs.jpcc.3c01698 |
| File: | http://dx.doi.org/10.1021/acs.jpcc.3c01698 |
601.
M. M. Elnagar,
P. V. Menezes,
W. A. Parada,
Y. Mattausch,
L. A. Kibler,
K. J. J. Mayrhofer and
T. Jacob,
"Tailoring Cu Electrodes for Enhanced CO2 Electroreduction through Plasma Electrolysis in Non‐Conventional Phosphorus‐Oxoanion‐Based Electrolytes",
ChemSusChem,
vol. 16,
no. 23,
Sep.
2023.
Wiley.
| DOI: | 10.1002/cssc.202300934 |
| File: | http://dx.doi.org/10.1002/cssc.202300934 |
600.
M. M. Elnagar,
J. Liessem,
C. Im,
D. Mitoraj,
L. A. Kibler,
C. Neumann,
A. Turchanin,
R. Leiter,
U. Kaiser,
T. Jacob,
I. Krivtsov and
R. Beranek,
"Water-soluble ionic carbon nitride as unconventional stabilizer for highly catalytically active ultrafine gold nanoparticles",
Nanoscale,
vol. 15,
no. 47,
pp. 19268–19281,
2023.
Royal Society of Chemistry (RSC).
| DOI: | 10.1039/d3nr03375a |
| File: | http://dx.doi.org/10.1039/D3NR03375A |
2022
599.
X. Liu,
T. Jacob and
W. Gao,
"Progress of fundamental mechanism of formic acid decomposition and electrooxidation",
Journal of Energy Chemistry,
vol. 70,
pp. 292–309,
Feb.
2022.
Elsevier B.V. and Science Press.
| DOI: | 10.1016/j.jechem.2022.02.017 |
| File: |  https://www.uni-ulm.de/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0239_HCOOH_Review_JEnergChem.pdf |
598.
P. Henkel,
S. Zahn,
J. Lorenz,
T. Jacob,
J. Janek and
D. Mollenhauer,
"Temperature-dependent Li vacancy diffusion in Li4Ti5O12 by means of first principles molecular dynamic simulations",
Phys. Chem. Chem. Phys.,
vol. 24,
pp. 5301–5316,
Feb.
2022.
Royal Society of Chemistry.
| DOI: | 10.1039/d1cp05126a |
| File: | https://www.uni-ulm.de/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0238_Li_diffusion_LTO_PhysChemChemPhys.pdf |
597.
H. K. Hassan,
A. Farkas,
A. Varzi and
T. Jacob,
"Mixed Metal‐Organic Frameworks as Efficient Semi‐Solid Electrolytes for Magnesium‐Ion Batteries",
Batteries and Supercaps,
vol. 10,
Jul.
2022.
Wiley.
| DOI: | https://doi.org/10.1002/batt.202200260 |
596.
S. Bertolini and
T. Jacob,
"Valence energy correction for electron reactive force field",
Journal of Computational Chemistry,
vol. 43(12),
pp. 870 - 877,
Mar.
2022.
Wiley Periodicals LLC.
| DOI: | 10.1002/jcc.26844 |
| File: | https://www.uni-ulm.de/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0240_eReaxFF_JCompChem.pdf |
595.
P. Stender,
H. Solodenko,
A. Weigel,
I. Balla,
T. Schwarz,
J. Ott,
M. Roussell,
R. Duran,
M. Al-Shakran,
T. Jacob and
G. Schmitz,
"A Modular Atom Probe Concept: Design, Operational Aspects, and Performance of an Integrated APT-FIB/SEM Solution",
Microscopy and Microanalysis,
vol. 28,
pp. 1168 - 1180,
Aug.
2022.
| DOI: | https://doi.org/10.1017/S1431927621013982 |
594.
S. Zaubitzer,
S. Dongmo,
P. Schüler,
S. Krieck,
F. Fiesinger,
D. Gaissmaier,
M. Borg,
T. Jacob,
M. Westerhausen,
M. Wohlfahrt-Mehrens and
M. Marinaro,
"A Novel and Highly Efficient Indolyl-Based Electrolyte for Mg Batteries",
Energy Technology,
vol. 10,
no. 8,
pp. 2200440,
Jun.
2022.
Wiley.
| DOI: | 10.1002/ente.202200440 |
593.
M. Varatnitskaya,
J. Fasel,
A. Müller,
N. Lupilov,
Y. Shi,
K. Fuchs,
M. Krewing,
C. Jung,
T. Jacob,
B. Sitek,
J. E. Bandow,
K. S. Carroll,
E. Hofmann and
L. I. Leichert,
"An increase in surface hydrophobicity mediates chaperone activity in N-chlorinated RidA",
Redox Biology,
vol. 53,
pp. 102332,
Jul.
2022.
Elsevier BV.
| DOI: | 10.1016/j.redox.2022.102332 |
592.
S. Zeller,
T. Geng,
M. U. Ceblin,
M. Uhl,
A. J. C. Kühne,
L. A. Kibler and
T. Jacob,
"An Interfacial Study of Au(111) Electrodes in Deep Eutectic Solvents",
ChemElectroChem,
vol. 9,
2022.
Wiley VCH.
| DOI: | 10.1002/celc.202200352 |
591.
J. Gacs,
E. S. Bogya,
L. Kocsis and
T. Jacob,
"Application of laser cleaning on AlMg4.5Mn0.4 sheets for adhesive bonding",
International Journal of Adhesion and Adhesives,
vol. 115,
pp. 103132,
Jun.
2022.
Elsevier BV.
| DOI: | 10.1016/j.ijadhadh.2022.103132 |
590.
A. Hoffmann,
M. Uhl,
M. Ceblin,
F. Rohrbach,
J. Bansmann,
M. Mallah,
H. Heuermann,
T. Jacob and
A. J. C. Kuehne,
"Atmospheric Pressure Plasma-Jet Treatment of PAN-Nonwovens - Carbonization of Nanofiber Electrodes",
C - Journal of Carbon Research,
vol. 8,
no. 3,
pp. 33,
Jun.
2022.
MDPI AG.
| DOI: | 10.3390/c8030033 |
589.
A. Hoffmann,
F. Rohrbach,
M. Uhl,
M. Ceblin,
T. Bauer,
M. Mallah,
T. Jacob,
H. Heuermann and
A. J. C. Kuehne,
"Atmospheric Pressure Plasma-Jet Treatment of Polyacrylonitrile-Nonwovens - Stabilization and Roll-to-Roll Processing",
Journal of Applied Polymer Science,
vol. 139,
no. 37,
Jul.
2022.
Wiley.
| DOI: | 10.1002/app.52887 |
588.
A. Hoffmann,
M. Uhl,
M. Ceblin,
J. Bansmann,
T. Jacob and
A. J. C. Kuehne,
"Atmospheric pressure plasma-jet treatment of polyacrylonitrile-nonwovens: Activation leading to high surface area carbon electrodes",
Plasma Processes and Polymers,
vol. 19,
no. 12,
pp. 2200114,
Aug.
2022.
Wiley.
| DOI: | 10.1002/ppap.202200114 |
587.
S. Bertolini and
T. Jacob,
"Atomistic discharge studies of sulfurized-polyacrylonitrile through ab initio molecular dynamics",
Electrochimica Acta 403 (2022),
vol. 139538,
pp. 1 - 7,
2022.
Elsevier Ltd..
| DOI: | 10.1016/j.electacta.2021.139538 |
| File: | https://www.uni-ulm.de/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0237_Li-SPAN_IV_ElectrochimActa.pdf |
586.
M. Van den Borg,
D. Gaissmaier,
D. Fantauzzi,
E. Knobbe and
T. Jacob,
"Atomistic Studies on Water-Induced Lithium Corrosion",
ChemSusChem,
vol. 15, e202101765,
pp. 1 - 10,
2022.
Wiley-VCH GmbH.
| DOI: | 10.1002/cssc.202101765 |
| File: | https://www.uni-ulm.de/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0236_Li_H2O_Corrosion_ChemSusChem.pdf |
585.
F. M. Matzik,
J. M. Hermann,
L. A. Kibler and
T. Jacob,
"Au(111) Surface Oxidation Kinetics Probed by Electrocatalytic Oxidation of Formic Acid",
Journal of the Electrochemical Society,
vol. 169/11,
2022.
ECS.
| DOI: | 10.1149/1945-7111/aca3d5 |
584.
D. Mitoraj,
I. Krivtsov,
C. Li,
A. Rajagopal,
C. Im,
C. Adler,
K. Köble,
O. Khainakova,
J. Hniopek,
C. Neumann,
A. Turchanin,
I. Silva,
M. Schmitt,
R. Leiter,
T. Lehnert,
J. Popp,
U. Kaiser,
T. Jacob,
C. Streb,
B. Dietzek and
R. Beranek,
"Corrigendum: A Study in Red: The Overlooked Role of Azo-Moieties in Polymeric Carbon Nitride Photocatalysts with Strongly Extended Optical Absorption",
Chemistry \textendash A European Journal,
vol. 28,
no. 52,
Sep.
2022.
Wiley.
| DOI: | 10.1002/chem.202202535 |
583.
C. Pastorio,
F. Zech,
S. Noettger,
C. Jung,
T. Jacob,
T. Sanderson,
K. M. J. Sparrer and
F. Kirchhoff,
"Determinants of Spike infectivity, processing, and neutralization in SARS-CoV-2 Omicron subvariants BA.1 and BA.2",
Cell Host &$\mathsemicolon$ Microbe,
vol. 30,
no. 9,
pp. 1255—1268.e5,
Sep.
2022.
Elsevier BV.
| DOI: | 10.1016/j.chom.2022.07.006 |