2020

546.
[Englisch] D. Gaissmaier, M. Van den Borg, D. Fantauzzi and T. Jacob, "Microscopic Properties of Na and Li—A First Principle Study of Metal Battery Anode Materials" , ChemSusChem, vol. 13, pp. 771 – 783, 2020. Wiley-VCH.
DOI:DOI: 10.1002/cssc.201902860
Datei:fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0198_Na_Li_Diffusion_Batteries_ChemSusChem.pdf
545.
[Englisch] D. Esau, F. M. Schuett, K. L. Varvaris, J. Björk, T. Jacob and G. Jerkiewicz, "Controlled-Atmosphere Flame Fusion Growth of Nickel Poly-oriented Spherical Single Crystals—Unraveling Decades of Impossibility" , Electrocatalysis, pp. 1 - 13; 25 - 34, 2020. Springer Science+Business Media.
DOI:https://doi.org/10.1007/s12678-019-00575-w
Datei:fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0196_Ni_SingleCrystals_Electrocatal.pdf
544.
[Englisch] B. Kirchhoff, L. Braunwarth, C. 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
Datei:fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0195_Pt_Nanoparticles_Small.pdf
543.
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
Datei:fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0194_CN_x_AngewandteChemie-de.pdf
542.
[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
Datei:fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0194_CN_x_AngewandteChemie_en.pdf
541.
[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
Datei:fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0197_Au_111__STM_stability_ChemElectroChem.pdf

2019

540.
C. 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
Datei:fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0192_GCMD_JChemTheoComp.pdf
539.
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
Datei:fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0191_MXenes_JCatal.pdf
538.
A. Abdelrahman, J. M. Hermann, T. Jacob and L. 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
Datei:fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0193_Acetate_Au111_ChemPhysChem.pdf
537.
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
Datei:fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0190_Reply_Comment_Sproules_ACIE_en.pdf
536.
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
Datei:fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0190_Reply_Comment_Sproules_ACIE_de.pdf
535.
M. Eckl, S. Zaubitzer, C. Köntje, A. Farkas, L. Kibler and T. Jacob, "An Electrochemical Route for Hot Alkaline Blackening of Steel: A Nitrite Free Approach" , Surfaces, vol. 2, pp. 1 - 12, 2019. MDPI.
DOI:10.3390/surfaces2020000
Datei:fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0187_Bruenieren_Surfaces.pdf
534.
533.
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, 2019. ACS Publications.
DOI:10.1021/acscatal.9b00733
Datei:fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0189_Ni_C_ACSCatal.pdf
532.
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, 2019. Wiley-VCH Verlag GmbH & Co.KKaA.
DOI:10.1002/celc.201801652
Datei:fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0184_Li-dendrites_ChemElectroChem.pdf
531.
[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, 2019. ACS Publications.
DOI:10.1021/acs.jpclett.8b03463
Datei:fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0183_MoSSe_vdW_Janus_JCPLett.pdf
530.
L. Blume, U. Sauter and T. Jacob, "Non-linear kinetics of the lithium-solid polymer electrolyte interface" , Electrochimica Acta, vol. 318, pp. 551 - 559, 2019. Elsevier Ltd.
DOI:10.1016/j.electacta.2019.06.070
Datei:fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0186_NonLinear_Kinetics_Batteries_ElectrochimActa.pdf
529.
T. E. Gorelik, R. Neder, M. W. Terban, Z. Lee, X. Mu, C. Jung, T. Jacob and U. Kaiser, "Towards quantitative treatment of electron pair distribution function" , Acta Crystallographica, vol. 75, pp. 532–549, 2019. International Union of Crystallography.
DOI:10.1107/S205252061900670X
Datei:fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0188_PDF_water_ActaCrystB.pdf
528.
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
Datei:fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0181_Li_self-diffusion_JCP.pdf
527.
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
Datei:fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0182_HER_Mo2S12_SusEnergFuels.pdf
526.
M. U. Ceblin, S. Zeller, L. 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
Datei:fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0180_Ag_DES_Ceblin_ChemElectroChem.pdf
525.
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
Datei:fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0179_Ru-perovskite_RGO_Part-II_JCollInterfSoc.pdf

2018

524.
J. M. Hermann, Y. Mattausch, A. Weiß, T. Jacob and L. 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, Okt. 2018.
DOI:10.1149/2.0251815jes
Datei:fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0178_Pyridine_HCOOH_Au111_Adzic-Issue_JElectrochemSoc.pdf
523.
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
Datei:fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0176_SolarSupercap_FrontChem.pdf
522.
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
Datei:fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0177_CC_DoubleBond_ACSNano.pdf