Essentially atomically smooth (100) and (110) n-TiO(2) (rutile) surfaces were prepared by immersion of commercially available single-crystal wafers in 20% HF, followed by annealing at 600 degrees C in air. The obtained surfaces were stable in aqueous solutions of pH 1-13, showing no change in the surface morphology on an atomic level, contrary to atomically flat surfaces prepared by ion sputtering and annealing under UHV. The success in preparation of the atomically smooth and stable n-TiO(2) surfaces enabled us to reveal clear crystal-face dependences of the surface band edges and hole reactivity in aqueous solutions.
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http://dx.doi.org/10.1021/jp044710t | DOI Listing |
Nanoscale
January 2025
School of Physics and Materials Science, Nanchang University, Nanchang, Jiangxi, 330031, People's Republic of China.
ACS Nano
January 2025
School of Physics and Astronomy, Monash University, Clayton, Victoria 3800, Australia.
Van der Waals electrode integration is a promising strategy to create nearly perfect interfaces between metals and 2D materials, with advantages such as eliminating Fermi-level pinning and reducing contact resistance. However, the lack of a simple, generalizable pick-and-place transfer technology has greatly hampered the wide use of this technique. We demonstrate the pick-and-place transfer of prefabricated electrodes from reusable polished hydrogenated diamond substrates without the use of any sacrificial layers due to the inherent low-energy and dangling-bond-free nature of the hydrogenated diamond surface.
View Article and Find Full Text PDFJ Chem Inf Model
January 2025
College of Information Science and Engineering, Huaqiao University, Xiamen 361021, China.
Machine learning methods for fitting potential energy surfaces and molecular dynamics simulations are becoming increasingly popular due to their potentially high accuracy and savings in computational resources. However, existing application models often rely on basic architectures like artificial neural networks (ANNs) and multilayer perceptron (MLP), lagging behind cutting-edge technologies in the machine learning domain. Furthermore, the complexity of current machine learning frameworks leads to reduced interpretability and challenges for improvement.
View Article and Find Full Text PDFJ Am Chem Soc
January 2025
School of Materials Science and Engineering, Nanyang Technological University, Singapore 639798, Singapore.
Two-dimensional (2D) PdSe atomic crystals hold great potential for optoelectronic applications due to their bipolar electrical characteristics, tunable bandgap, high electron mobility, and exceptional air stability. Nevertheless, the scalable synthesis of large-area, high-quality 2D PdSe crystals using chemical vapor deposition (CVD) remains a significant challenge. Here, we present a self-limiting liquid-phase edge-epitaxy (SLE) low-temperature growth method to achieve high-quality, centimeter-sized PdSe films with single-crystal domain areas exceeding 30 μm.
View Article and Find Full Text PDFNano Lett
January 2025
Department of Advanced Materials Science, The University of Tokyo, Kashiwa, Chiba 277-8561, Japan.
Achieving atomic-level characterization of the diamond (001) surface has been a persistent goal over recent decades. This pursuit aims to understand the smooth growth of diamonds and investigate surface defects and adsorbates relevant to applications. However, the inherently low conductivity and the short C-C bonds present significant challenges for atomic resolution imaging.
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