Adsorption of NH3 with Different Coverages on Single-Walled ZnO Nanotube: DFT and QTAIM Study Abstract: NH3 adsorption with different coverages on single-walled armchair and zigzag ZnO nanotubes (ZnONT) has been studied via periodic computational simulations at […]
The interplay between morphology and photocatalytic activity in ZnO and N-doped ZnO crystals Abstract: Intrinsic characteristics of the material such as superficial area, morphological structure, and crystalline phase exposition play a fundamental role in the corresponding […]
“CDMF Pesquisa” apresenta Valmor Roberto Mastelaro, professor do Instituto de Física de São Carlos da Universidade de São Paulo (IFSC – USP) e pesquisador do Centro de Desenvolvimento de Materiais Funcionais (CDMF). No vídeo, o […]
Oligo- and Poly(fullerene)s for Photovoltaic Applications: Modeled Electronic Behaviors and Synthesis Abstract: The atom transfer radical addition polymerization (ATRAP) of fullerene to give poly(fullerene)s (PFs) for organic electronics is explored. Quantum chemistry maps the expected electronic […]
Combined theoretical and nanoscale experimental study of Pb(Ca,Ba) TiO3, Pb(Sr,Ba)TiO3, and Pb(Sr,Ca)TiO3 complex perovskite structures: An investigation of the ferroelectric and electronic properties Abstract: Combined experimental and first-principles studies have been conducted to obtain a fundamental […]
Identification and classification of polymer e-waste using laser-induced breakdown spectroscopy (LISS) and chemometric tools Abstract: In the recycling of polymer e-waste, there is a pressing need for rapid measurement technologies for the simple identification and classification […]
Mechanism of Antibacterial Activity via Morphology Change of alpha-AgVO3: Theoretical and Experimental Insights Abstract: The electronic configuration, morphology, optical features, and antibacterial activity of metastable alpha-AgVO3 crystals have been discussed by a conciliation and association of […]
High-Utilisation Nanoplatinum Catalyst (Pt@cPIM) Obtained via Vacuum Carbonisation in a Molecularly Rigid Polymer of Intrinsic Microporosity Abstract: Polymers of intrinsic microporosity (PIM or here PIM-EA-TB) offer a highly rigid host environment into which hexachloroplatinate(IV) anions are […]
The impact of antimicrobial photodynamic therapy on peri-implant disease: What mechanisms are involved in this novel treatment? Abstract: According to the American Academy of Implant Dentistry. 3 million Americans have dental implants, and this number is […]
Single-nanotube tracking reveals the nanoscale organization of the extracellular space in the live brain Abstract: The brain is a dynamic structure with the extracellular space (ECS) taking up almost a quarter of its volume(1,2). Signalling molecules, […]
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