2023

664.
B. Kirchhoff, C. Jung, D. Gaissmaier, L. Braunwarth, D. Fantauzzi and T. Jacob, "In-silico characterization of nanoparticles", Physical Chemistry Chemical Physics, vol. 25, no. 19, pp. 13228–13243, 2023. Royal Society of Chemistry (RSC).
DOI:10.1039/d3cp01073b
Datei:http://dx.doi.org/10.1039/D3CP01073B
663.
O. W. Elkhafif, H. K. Hassan, M. U. Ceblin, A. Farkas and T. Jacob, "Influence of Residual Water Traces on the Electrochemical Performance of Hydrophobic Ionic Liquids for Magnesium‐Containing Electrolytes", ChemSusChem, vol. 16, no. 19, Jul. 2023. Wiley.
DOI:10.1002/cssc.202300421
Datei:http://dx.doi.org/10.1002/cssc.202300421
662.
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
Datei:https://doi.org/10.1002%2Fange.202214927
661.
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
Datei:http://dx.doi.org/10.1039/D3GC01614E
660.
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
659.
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
Datei:http://dx.doi.org/10.1002/cphc.202200336
658.
B. W. Schick, X. Hou, V. Vanoppen, M. Uhl, M. Kruck, E. J. Berg and T. Jacob, "Revealing the Structural Evolution of Electrode/Electrolyte Interphase Formation during Magnesium Plating and Stripping with operando EQCM‐D", ChemSusChem, Nov. 2023. Wiley.
DOI:10.1002/cssc.202301269
Datei:http://dx.doi.org/10.1002/cssc.202301269
657.
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
Datei:http://dx.doi.org/10.1021/acs.chemmater.2c02843
656.
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
Datei:http://dx.doi.org/10.1021/acs.jpcc.3c01698
655.
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
Datei:http://dx.doi.org/10.1002/cssc.202300934
654.
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
Datei:http://dx.doi.org/10.1039/D3NR03375A

2022

653.
T. Jacob, L. A. Kibler and Y. Sheasha, "Electrolyte for Chromium Deposition from CR(III)-Compounds", Apr. 2022.
652.
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
Datei:pdfhttps://www.uni-ulm.de/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0239_HCOOH_Review_JEnergChem.pdf
651.
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
Datei:pdfhttps://www.uni-ulm.de/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0238_Li_diffusion_LTO_PhysChemChemPhys.pdf
650.
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
649.
S. Bertolini and T. Jacob, "Valence energy correction for electron reactive force field", Journal of Computational Chemistry, vol. 43(12), pp. 870 - 877, Mä. 2022. Wiley Periodicals LLC.
DOI:10.1002/jcc.26844
Datei:pdfhttps://www.uni-ulm.de/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0240_eReaxFF_JCompChem.pdf
648.
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
647.
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
646.
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
645.
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
644.
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
643.
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
642.
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
641.
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
640.
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
Datei:pdfhttps://www.uni-ulm.de/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0237_Li-SPAN_IV_ElectrochimActa.pdf