Publications - Articles

2020

530.
[Englisch] B. Kirchhoff, L. Braunwarth, C. K. Jung, H. Jonsson, D. Fantauzzi and T. Jacob, "Simulations of the Oxidation and Degradation of Platinum Electrocatalysts", Small, vol. 16, pp. 1 - 7, 2020. Wiley-VCH.
DOI:doi.org/10.1002/smll.201905159
File:/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0195_Pt_Nanoparticles_Small.pdf
529.
[Englisch] A. V. Rudnev, M. R. Ehrenburg, E. B. Molodkina, A. Abdelrahman, M. Arenz, P. Broekmann and T. Jacob, "Structural Changes of Au(111) Single-Crystal Electrode Surface in Ionic Liquids", ChemElectroChem, vol. 7, pp. 501 - 508, 2020. Wiley-VCH.
DOI:DOI: 10.1002/celc.201902010
File:/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0197_Au_111__STM_stability_ChemElectroChem.pdf
528.
S. Amthor, H. Braun, J. Gröne, D. Nauroozi, T. Jacob and S. Rau, "Tailored protective groups for surface immobilization of ruthenium dyes", Dalton Transactions, vol. 49, pp. 3735-2742, 2020. The Royal Society of Chemistry.
DOI:10.1039/c9dt03591e
File:/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0199_Ru_photocomplexes_DaltonTrans.pdf
527.
I. Krivtsov, D. Mitoraj, C. Adler, M. Ilkaeva, M. Sardo, L. Mafra, C. Neumann, A. Turchanin, C. Li, B. Dietzek, R. Leiter, J. Biskupek, U. Kaiser, C. Im, B. Kirchhoff, T. Jacob and R. Beranek, "Water-Soluble Polymeric Carbon Nitride Colloidal Nanoparticles for Highly Selective Quasi-Homogeneous Photocatalysis", Angwandte Chemie, vol. 132, pp. 495 - 503, 2020. Wiley-VCH GmbH & Co. KGaA.
DOI:DOI: 10.1002/ange.201913331
File:/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0194_CN_x_AngewandteChemie-de.pdf
526.
[Englisch] I. Krivtsov, D. Mitoraj, C. Adler, M. Ilkaeva, M. Sardo, L. Mafra, C. Neumann, A. Turchanin, C. Li, B. Dietzek, R. Leiter, J. Biskupek, U. Kaiser, C. Im, B. Kirchhoff, T. Jacob and R. Beranek, "Water-Soluble Polymeric Carbon Nitride Colloidal Nanoparticles for Highly Selective Quasi-Homogeneous Photocatalysis", Angewandte Chemie, vol. 59, pp. 487 – 495, 2020. Wiley-VCH.
DOI:DOI: 10.1002/anie.201913331
File:/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0194_CN_x_AngewandteChemie_en.pdf

2019

525.
C. K. Jung, L. Braunwarth and T. Jacob, "Grand Canonical ReaxFF Molecular Dynamics Simulations for Catalytic Reactions", Journal of Chemical Theory and Computation, vol. 15, pp. 5810−5816, Sep. 2019. ACS Publications.
DOI:10.1021/acs.jctc.9b00687
File:/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0192_GCMD_JChemTheoComp.pdf
524.
X. Lv, W. Wei, P. Zhao, D. Er, B. Huang, Y. Dai and T. Jacob, "Oxygen-terminated BiXenes and derived single atom catalysts for the hydrogen evolution reaction", Journal of Catalysis, vol. 378, pp. 97–103, Sep. 2019. Elsevier Inc..
DOI:10.1016/j.jcat.2019.08.019
File:/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0191_MXenes_JCatal.pdf
523.
A. Abdelrahman, J. M. Hermann, T. Jacob and L. A. Kibler, "Adsorption of Acetate on Au(111): An in-situ Scanning Tunnelling Microscopy Study and Implications on Formic Acid Electrooxidation", ChemPhysChem, vol. 20, pp. 2989 – 2996, Aug. 2019. Wiley-VCH.
DOI:10.1002/cphc.201900560
File:/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0193_Acetate_Au111_ChemPhysChem.pdf
522.
M. Anjass, K. Kastner, F. Nägele, M. Ringenberg, J. F. Boas, J. Zhang, A. M. Bond, T. Jacob and C. Streb, "Antwort auf den Kommentar zu „Stabilisierung eines niedrigvalenten Eisen(I)-Ions in einem hochvalentem molekularen Vanadium(V) Oxid-Cluster“", Angewandte Chemie, vol. 131, pp. 10151 – 10153, Jul. 2019. Wiley-VCH.
DOI:10.1002/ange.201902460
File:/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0190_Reply_Comment_Sproules_ACIE_de.pdf
521.
M. Anjass, K. Kastner, F. Nägele, M. Ringenberg, J. F. Boas, J. Zhang, A. M. Bond, T. Jacob and C. Streb, "Reply to Comment on Stabilization of Low-Valent Iron(I) in a High-Valent Vanadium(V) Oxide Cluster", Angewandte Chemie, vol. 58, pp. 10048 – 10050, Jul. 2019. Wiley-VCH.
DOI:10.1002/anie.201902460
File:/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0190_Reply_Comment_Sproules_ACIE_en.pdf
520.
M. Eckl, S. Zaubitzer, C. Köntje, A. Farkas, L. A. Kibler and T. Jacob, "An Electrochemical Route for Hot Alkaline Blackening of Steel: A Nitrite Free Approach", Surfaces, vol. 2, pp. 1 - 12, Mar. 2019. MDPI.
DOI:10.3390/surfaces2020000
File:/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0187_Bruenieren_Surfaces.pdf
519.
A. Gili, L. Schlicker, M. F. Bekheet, O. Görke, D. Kober, U. Simon, P. Littlewood, R. Schomäker, A. Doran, D. Gaissmaier, T. Jacob, S. Selve and A. Gurlo, "Revealing the Mechanism of Multiwalled Carbon Nanotube Growth on Supported Nickel Nanoparticles by in Situ Synchrotron X‐ray Diffraction, Density Functional Theory, and Molecular Dynamics Simulations", ACS Catalysis, vol. 9, pp. 6999-7011, Jun. 2019. ACS Publications.
DOI:10.1021/acscatal.9b00733
File:/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0189_Ni_C_ACSCatal.pdf
518.
A. A. Rulev, A. V. Sergeev, L. V. Yashina, T. Jacob and D. M. Itkis, "Electromigration in Lithium Whisker Formation Plays Insignificant Role during Electroplating", ChemElectroChem, vol. 6, pp. 1324 – 1328, Jan. 2019. Wiley-VCH Verlag GmbH & Co.KKaA.
DOI:10.1002/celc.201801652
File:/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0184_Li-dendrites_ChemElectroChem.pdf
517.
[englisch] F. Li, W. Wei, H. Wang, B. Huang, Y. Dai and T. Jacob, "Intrinsic Electric Field-Induced Properties in Janus MoSSe van der Waals Structures", The Journal of Physical Chemistry Letters 2019, vol. 10, pp. 559 - 565, Jan. 2019. ACS Publications.
DOI:10.1021/acs.jpclett.8b03463
File:/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0183_MoSSe_vdW_Janus_JCPLett.pdf
516.
L. Blume, U. Sauter and T. Jacob, "Non-linear kinetics of the lithium-solid polymer electrolyte interface", Electrochimica Acta, vol. 318, pp. 551 - 559, Jun. 2019. Elsevier Ltd.
DOI:10.1016/j.electacta.2019.06.070
File:/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0186_NonLinear_Kinetics_Batteries_ElectrochimActa.pdf
515.
T. E. Gorelik, R. Neder, M. W. Terban, Z. Lee, X. Mu, C. K. Jung, T. Jacob and U. Kaiser, "Towards quantitative treatment of electron pair distribution function", Acta Crystallographica, vol. 75, pp. 532–549, May 2019. International Union of Crystallography.
DOI:10.1107/S205252061900670X
File:/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0188_PDF_water_ActaCrystB.pdf
514.
M. U. Ceblin, S. Zeller, L. A. Kibler, T. Jacob and B. Schick, "Electrodeposition of Ag onto Au(111) from Deep Eutectic Solvents", ChemElectroChem, vol. 6, pp. 141 – 146, 2019. Wiley-VCH.
DOI:10.1002/celc.201801192
File:/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0180_Ag_DES_Ceblin_ChemElectroChem.pdf
513.
A. Galal, H. K. Hassan, N. F. Atta and T. Jacob, "Energy and cost-efficient nano-Ru-based perovskites/RGO composites for application in high performance supercapacitors ", Journal of Colloid and Interface Science, vol. 538, pp. 578 – 586, 2019. Elsevier Inc..
DOI:10.1016/j.jcis.2018.12.018
File:/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0179_Ru-perovskite_RGO_Part-II_JCollInterfSoc.pdf
512.
D. Gaissmaier, D. Fantauzzi and T. Jacob, "First principles studies of self-diffusion processes on metallic lithium surfaces", The Journal of Chemical Physics, vol. 150, no. 041723, pp. 1 - 14, 2019. AIP Publishing.
DOI:10.1063/1.5056226
File:/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0181_Li_self-diffusion_JCP.pdf
511.
A. Rajagopal, F. Venter, T. Jacob, L. Petermann, S. Rau, S. Tschierlei and C. Streb, "Homogeneous visible light-driven hydrogen evolution by the molecular molybdenum sulfide model [Mo2S12]2", Sustainable Energy Fuels, vol. 3, pp. 92 – 95, 2019. The Royal Society of Chemistry.
DOI:10.1039/c8se00346g
File:/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0182_HER_Mo2S12_SusEnergFuels.pdf

2018

510.
J. M. Hermann, Y. Mattausch, A. Weiß, T. Jacob and L. A. Kibler, "Enhanced Electrocatalytic Oxidation of Formic Acid on Au(111) in the Presence of Pyridine ", Journal of The Electrochemical Society, vol. 165, pp. J3192 - J3198, Oct. 2018.
DOI:10.1149/2.0251815jes
File:/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0178_Pyridine_HCOOH_Au111_Adzic-Issue_JElectrochemSoc.pdf
509.
A. Scalia, A. Varzi, A. Lamberti, T. Jacob and S. Passerini, "Portable High Voltage Integrated Harvesting-Storage Device Employing Dye-Sensitized Solar Module and All-Solid-State Electrochemical Double Layer Capacitor", Frontiers in Chemistry, vol. 6, no. 443, pp. 1 - 8, Sep. 2018.
DOI:10.3389/fchem.2018.00443
File:/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0176_SolarSupercap_FrontChem.pdf
508.
S. Hu, W. Xu, X. Qiu, J. Zhu, J. Björk, T. Jacob, C. Yuan, J. Zou, L. Xu, L. Cai, H. Ju, H. Ma, J. Pan, Z. Zha, M. Bao, Q. Sun, M. Liu and X. Yu, "Direct Formation of C−C Double-Bonded Structural Motifs by On-Surface Dehalogenative Homocoupling of gem- Dibromomethyl Molecules", ACS Nano, vol. 12, pp. 7959−7966, Jul. 2018.
DOI:10.1021/acsnano.8b02459
File:/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0177_CC_DoubleBond_ACSNano.pdf
507.
A. Galal, H. K. Hassan, N. F. Atta and T. Jacob, "Effect of Redox Electrolyte on the Specific Capacitance of SrRuO3− Reduced Graphene Oxide Nanocomposites", The Journal of Physical Chemistry, vol. 122, pp. 11641 - 11650, 2018. ACS Publications.
DOI:10.1021/acs.jpcc.8b02068
File:/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0173_SrRuO3_RGO_JPC-C.pdf
506.
H. Müller, M. Metzler, N. Barth, B. Conings, H. -. Boyen, T. Jacob and L. A. Kibler, "Electrocatalytic Behavior of Pd and Pt Nanoislands Deposited onto 4,4′-Dithiodipyridine SAMs on Au(111)", Electrocatalysis, vol. 9, pp. 505 – 513, 2018. Springer Science+Business Media.
DOI:10.1007/s12678-018-0467-1
File:/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0172_Pt_Pd_SAM_Au_Electrocatal.pdf