Publications at the Department of Mathematics and Natural Sciences from 2019

Results: 896
Created on: Wed, 24 Apr 2024 23:08:36 +0200 in 0.0936 sec


Xu, Dongbo; Zhang, Song; Yu, Yangfei; Zhang, Shu; Ding, Qijia; Lei, Yong; Shi, Weidong
Ultrathin metal Ni layer on ZnO/TiO2 photoelectrodes with excellent photoeletrochemical performance in multiple electrolyte solutions. - In: Fuel, ISSN 1873-7153, Bd. 351 (2023), 128774

It is well known that the oxygen vacancy (Ovac) as the electron-donor dopant in semiconductor can increase the electron-holes separation in photoeletrochemical (PEC) water splitting. Furthermore, the metal Ni can promote the hydrogen evolution reaction (HER) on the surface of semiconductor. In this paper, the ZnO/TiO2 photoelectrodes with rich Ovac was synthesized by electrostatic adsorption through using ZIF-8 as the precursor. Then the ultrathin Ni layer with about 7 nm was deposited on the surface of ZnO/TiO2 (Ni/ZnO/TiO2) by vacuum thermal evaporation method. The Ni/ZnO/TiO2 photoelectrodes showed the highest photocurrent than ZnO/TiO2, Ni/ TiO2 and pure TiO2 photoelectrodes. The durability of Ni/ZnO/TiO2 photoelectrodes was keeping for 10 h in multiple electrolyte solutions under AM 1.5 G illumination and the photocurrent decline can be ignored. The UV-vis absorption spectra demonstrated that the ultrathin Ni layer showed plasma with ZnO/TiO2 for enhancing the water splitting performance. Furthermore, the ultrathin Ni layer enhanced the photogenerated charges transfer for improving the PEC performance. This work provides a new method for ultrathin metal Ni layer with Ovac semiconductor photoelectrode to improve the PEC performance in multiple electrolyte solutions.



https://doi.org/10.1016/j.fuel.2023.128774
Zeußel, Lisa; Schober, Andreas; Ullmann, Fabian; Krischok, Stefan; Heinrich, Doris; Singh, Sukhdeep
Visible-light-assisted donor-acceptor-Stenhouse-adduct-based reversible photoswitching on a laser-structurable OrmoComp substrate. - In: ACS applied polymer materials, ISSN 2637-6105, Bd. 5 (2023), 10, S. 8631-8640

Laser-assisted nanolithography of commercially available photoresists is offering a limitless designing opportunity in the micro- and nanostructuring of 3D organotypic cell culture scaffolds. Among them, chemically functionalized OrmoComp has shown promising improvement in cell adhesion that paves the way to assemble cellular entities on a desirable geometry. Establishing a photoswitchable chemistry on the OrmoComp surface may offer an additional degree of freedom to manipulate the surface chemistry locally and selectively. We have established the methods for functionalization of the photopolymerized OrmoComp surface with visible-light-switchable donor-acceptor Stenhouse adducts. Unlike other polymers, a photopolymerized OrmoComp surface appears to be optimal for reversible photothermal switching, offering the possibility to influence surface properties like absorption and hydrophilicity tremendously. Light-assisted chemical modulation between colored triene-2-ol and colorless cyclopentenone can be achieved to a size region as narrow as 20 μm. Thermal reversion to the original triene-2-ol state can be analyzed spectroscopically and observed with the naked eye.



https://doi.org/10.1021/acsapm.3c01766
¸Sen, Gök¸cen Devlet; Schaller, Manuel; Worthmann, Karl
Stage-cost design for optimal and model predictive control of linear port-Hamiltonian systems: energy efficiency and robustness. - In: Proceedings in applied mathematics and mechanics, ISSN 1617-7061, Bd. 23 (2023), 4, e202300296, S. 1-9

We consider singular optimal control of port-Hamiltonian systems with minimal energy supply. We investigate the robustness of different stage-cost designs w.r.t. time discretization and show that alternative formulations that are equivalent in continuous time, differ strongly in view of discretization. Furthermore, we consider the impact of additional quadratic control regularization and demonstrate that this leads to a considerable increase in energy consumption. Then, we extend our results to the tracking problem within model predictive control and show that the intrinsic but singular choice of the cost functional as the supplied energy leads to a substantial improvement of the closed-loop performance.



https://doi.org/10.1002/pamm.202300296
Mathew, Sobin; Reiprich, Johannes; Narasimha, Shilpashree; Abedin, Saadman; Kurtash, Vladislav; Thiele, Sebastian; Scheler, Theresa; Hähnlein, Bernd; Schaaf, Peter; Jacobs, Heiko O.; Pezoldt, Jörg
Gate-tunable hysteresis response of field effect transistor based on sulfurized Mo. - In: AIP Advances, ISSN 2158-3226, Bd. 13 (2023), 9, 095224, S. 095224-1-095224-7

Hysteresis effects and their tuning with electric fields and light were studied in thin film molybdenum disulfide transistors fabricated from sulfurized molybdenum films. The influence of the back-gate voltage bias, voltage sweep range, illumination, and AlOx encapsulation on the hysteresis effect of the back-gated field effect transistors was studied and quantified. This study revealed the distinctive contribution of MoS2 surface, MoS2/SiO2 interface defects and their associated traps as primary sources of of hysteresis.



https://doi.org/10.1063/5.0165868
Espuny Díaz, Alberto; Hyde, Joseph
Powers of Hamilton cycles in dense graphs perturbed by a random geometric graph. - In: European journal of combinatorics, Bd. 0 (2023), 0, 103848

Let G be a graph obtained as the union of some n-vertex graph Hn with minimum degree δ (Hn) ≥ αn and a d-dimensional random geometric graph Gd (n,r). We investigate under which conditions for r the graph G will a.a.s. contain the kth power of a Hamilton cycle, for any choice of Hn. We provide asymptotically optimal conditions for r for all values of α, d and k. This has applications in the containment of other spanning structures, such as F-factors.



https://doi.org/10.1016/j.ejc.2023.103848
Hou, Minjie; Zhou, Yingjie; Liang, Feng; Zhao, Huaping; Ji, Deyang; Zhang, Da; Li, Liqiang; Lei, Yong
Research progress of solid electrolyte interphase for sodium metal anodes. - In: The chemical engineering journal, ISSN 1873-3212, Bd. 475 (2023), 146227

Inhomogeneous and fragile solid electrolyte interphase (SEI) leads to poor battery cycle life and safety hazards, which is a key challenge that limits the practical application of low-cost sodium metal anodes. Although sodium metal batteries based on non-aqueous liquid and solid electrolytes have made great progress in terms of interfacial chemistry and SEI regulation strategies, the relevant evaluation of SEI from the perspective of the electrolyte is not well understood. This paper reviews the formation mechanism, physicochemical properties, and failure mechanism of SEI at the interface between the sodium metal and the liquid/solid electrolyte, focusing on poor stability, compatibility, interfacial ion transport problems, and influencing factors. Recent advances in SEI regulation are summarized in terms of electrolytes, artificial interphases, and electrode engineering to achieve ideal electrochemical reversibility. The effectiveness of the SEI engineering strategies was evaluated based on a comprehensive review of the interfacial stability in different electrolyte systems. Finally, the challenges associated with rational interface design for long-lasting sodium metal batteries are discussed, along with promising avenues for the same.



https://doi.org/10.1016/j.cej.2023.146227
Bartel, Andreas; Günther, Michael; Jacob, Birgit; Reis, Timo
Operator splitting based dynamic iteration for linear differential-algebraic port-Hamiltonian systems. - In: Numerische Mathematik, ISSN 0945-3245, Bd. 155 (2023), 1, S. 1-34

A dynamic iteration scheme for linear differential-algebraic port-Hamiltonian systems based on Lions-Mercier-type operator splitting methods is developed. The dynamic iteration is monotone in the sense that the error is decreasing and no stability conditions are required. The developed iteration scheme is even new for linear port-Hamiltonian systems governed by ODEs. The obtained algorithm is applied to a multibody system and an electrical network.



https://doi.org/10.1007/s00211-023-01369-5
Hou, Shengping; Xie, Zhipeng; Zhang, Da; Yang, Bin; Lei, Yong; Liang, Feng
High-purity graphene and carbon nanohorns prepared by base-acid treated waste tires carbon via direct current arc plasma. - In: Environmental research, ISSN 1096-0953, Volume 238 (2023), part 1, 117071

As the accumulation of waste tires continues to rise year by year, effectively managing and recycling these discarded materials has become an urgent global challenge. Among various potential solutions, pyrolysis stands out due to its superior environmental compatibility and remarkable efficiency in transforming waste tires into valuable products. Thus, it is considered the most potential method for disposing these tires. In this work, waste tire powder is pyrolyzed at 560 ˚C to yield pyrolysis carbon black, and meanwhile, the purification effects of base-acid solutions on pyrolysis carbon black are discussed. High-purity few-layer graphene flakes and carbon nanohorns are synthesized by a direct current arc plasma with H2 and N2 as buffer gases and high-purity pyrolysis carbon black as raw material. Under an H2 atmosphere, hydrogen effectively terminates the suspended carbon bonds, preventing the formation of closed structures and facilitating the expansion of graphene sheets. During the preparation of carbon nanohorns, the nitrogen atoms rapidly bond with carbon atoms, forming essential C-N bonds. This nitrogen doping promotes the formation of carbon-based five-membered and seven-membered rings and makes the graphite lamellar change in the direction of towards negative curvature. Consequently, such change facilitates the formation of conical structures, ultimately yielding the coveted carbon nanohorns. This work not only provides an economical raw material for efficient large-scale synthesis of few-layer graphene and carbon nanohorns but also broadens the intrinsic worth of pyrolysis carbon black, which is beneficial to improving the recycling value of waste tires.



https://doi.org/10.1016/j.envres.2023.117071
Finkelmeyer, Sarah; Askins, Erik J.; Eichhorn, Jonas; Ghosh, Soumik; Siegmund, Carmen; Täuscher, Eric; Dellith, Andrea; Hupfer, Maximilian; Dellith, Jan; Ritter, Uwe; Strzalka, Joseph; Glusac, Ksenija; Schacher, Felix; Presselt, Martin
Tailoring the weight of surface and intralayer edge states to control LUMO energies. - In: Advanced materials, ISSN 1521-4095, Bd. 35 (2023), 40, 2305006, S. 1-11

The energies of the frontier molecular orbitals determine the optoelectronic properties in organic films, which are crucial for their application, and strongly depend on the morphology and supramolecular structure. The impact of the latter two properties on the electronic energy levels relies primarily on nearest-neighbor interactions, which are difficult to study due to their nanoscale nature and heterogeneity. Here, an automated method is presented for fabricating thin films with a tailored ratio of surface to bulk sites and a controlled extension of domain edges, both of which are used to control nearest-neighbor interactions. This method uses a Langmuir–Schaefer-type rolling transfer of Langmuir layers (rtLL) to minimize flow during the deposition of rigid Langmuir layers composed of π-conjugated molecules. Using UV–vis absorption spectroscopy, atomic force microscopy, and transmission electron microscopy, it is shown that the rtLL method advances the deposition of multi-Langmuir layers and enables the production of films with defined morphology. The variation in nearest-neighbor interactions is thus achieved and the resulting systematically tuned lowest unoccupied molecular orbital (LUMO) energies (determined via square-wave voltammetry) enable the establishment of a model that functionally relates the LUMO energies to a morphological descriptor, allowing for the prediction of the range of accessible LUMO energies.



https://doi.org/10.1002/adma.202305006
Yu, Yan; He, Guping; Zhu, Ximiao; Yu, Jiahai; Shi, Yiwen; Lei, Yong; Sun, Fengqiang
A flexible humidity sensor constructed by ordered-pore-array of slightly reduced graphene oxide with much enhanced sensing response. - In: Surfaces and Interfaces, ISSN 2468-0230, Bd. 41 (2023), 103204

Reduced graphene oxide (rGO) flexible film humidity sensor has received increasing attention, but the low sensing response caused by lack of available hydrophilic functional groups is still a limitation. Herein, a slightly reduced graphene oxide (SrGO) ordered-pore-array, fabricated via a monolayer colloid crystal template method, was introduced as a resistive humidity sensor. It was obtained based on adsorption between the GO sheets and the template microspheres, in-situ slight reduction of the GO shells and the removal of template. The reduction way allows the functional groups of GO to be retained as much as possible, and the unique structures (e.g., spherical double surfaces and small through-holes on pore-walls) facilitate the substantial exposure of functional groups, the penetration of water molecules and the utilization of buried functional groups. The available functional groups are thereby efficiently increased, giving the sensor an unprecedented high sensing response, more than 2600 times the maximum response of existing rGO sensors. The sensor also demonstrated excellent practical characteristics, and by detecting a single exhale, it could be employed in quick and quantitative evaluation of human activities and health. This strategy paves a facile and promising route to improve the sensing response and application of graphene-based humidity sensors or gas sensors.



https://doi.org/10.1016/j.surfin.2023.103204