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The effect of optical radiation on the rate of aggregation of nanoscopic particles is studied in metal aerosols. It has been shown that under light exposure, polydisperse metal aerosols can aggregate up to two orders faster due to the size…

Chemical Physics · Physics 2010-10-07 Sergei V. Karpov , Ivan L. Isaev

An Atomic Force Microscope is used to locally manipulate a single layer graphene sheet. Transport measurements in this region as well as in the unmanipulated part reveal different charge carrier densities while mobilities stay in the order…

Mesoscale and Nanoscale Physics · Physics 2015-06-12 H. Schmidt , J. C. Rode , C. Belke , D. Smirnov , R. J. Haug

We study the bonding and diffusion of Au in graphene vacancies using density-functional theory. Energetics show that Au adsorbs preferably to double vacancies, steadily in-plane with graphene. All diffusion barriers for the complex of Au in…

Materials Science · Physics 2009-02-16 S. Malola , H. Häkkinen , P. Koskinen

Carbon nanoscrolls (CNSs) are nanomaterials with geometry resembling graphene layers rolled up into a spiral (papyrus-like) form. Effects of hydrogenation and temperature on the self-scrolling process of two nanoribbons interacting with a…

Materials Science · Physics 2022-08-02 M. L. Pereira Júnior , L. A. Ribeiro Júnior , D. S. Galvão , J. M. De Sousa

The interaction between macroscopic fluid flow and nanoscale forces has resulted in the formation of long-range assemblies through evaporation-induced self-assembly. Anisotropic gold nanorods (AuNR) can form disordered, smectic, or…

Soft Condensed Matter · Physics 2025-02-28 NP Vaisakh , Suman Bhattacharjee , Sunita Srivastava

The electronic properties of graphene nano-flakes (GNFs) with different edge passivation is investigated by using density functional theory. Passivation with F and H atoms are considered: C$_{N_c}$ X$_{N_x}$ (X=F or H). We studied GNFs with…

Materials Science · Physics 2014-03-05 Sandeep Kumar Singh , M. Neek-Amal , F. M. Peeters

We show theoretically that in the external magnetic field like charges on top of graphene monolayer may be mutually attracted to form macro-molecules. For this to happen graphene needs to be in Quantum Hall plateau state with local chemical…

Mesoscale and Nanoscale Physics · Physics 2015-11-26 Sergey Slizovskiy

Gold nanoparticles (AuNPs) play an important role in fundamental research and development due to their versatile applications and biocompatibility. This study addresses the aging of three AuNP suspensions after the addition of various…

Soft Condensed Matter · Physics 2025-02-04 Philipp Ritzert , Alexandra Striegel , Regine von Klitzing

We have theoretically investigated the electronic and magnetic properties of graphene whose zigzag edges are oxidized. The alteration of these properties by adsorption of $\mathrm{H_{2}O}$ and $\mathrm{NH_3}$ molecules have been considered.…

Chemical Physics · Physics 2015-05-14 Julia Berashevich , Tapash Chakraborty

Graphene can at present be grown at large quantities only by the chemical vapor deposition method, which produces polycrystalline samples. Here, we describe a method for constructing realistic polycrystalline graphene samples for atomistic…

Materials Science · Physics 2012-05-28 Jani Kotakoski , Jannik C. Meyer

We investigate the optical properties of edge-functionalized graphene nanosystems, focusing on the formation of junctions and charge transfer excitons. We consider a class of graphene structures which combine the main electronic features of…

Materials Science · Physics 2011-05-18 Caterina Cocchi , Deborah Prezzi , Alice Ruini , Marilia J. Caldas , Elisa Molinari

Spin-orbit splitting in graphene on Ni, Au, or Ag (111) substrates was examined on the basis of density-functional theory. Graphene grown on the three metals was found to have Rashba splitting of a few or several tens of meV. The strong…

Mesoscale and Nanoscale Physics · Physics 2010-08-05 Z. Y. Li , S. Qiao , Z. Q. Yang , R. Q. Wu

We show that the radiative heat flux between two nanoparticles can be significantly amplified when they are placed in proximity of a planar substrate supporting a surface resonance. The amplification factor goes beyond two orders of…

Mesoscale and Nanoscale Physics · Physics 2018-05-02 Riccardo Messina , Svend-Age Biehs , Philippe Ben-Abdallah

Graph convolutional neural networks (GCNNs) have been attracting increasing research attention due to its great potential in inference over graph structures. However, insufficient effort has been devoted to the aggregation methods between…

Machine Learning · Computer Science 2019-05-15 Penghui Sun , Jingwei Qu , Xiaoqing Lyu , Haibin Ling , Zhi Tang

Polymer-grafted nanoparticles (PGNPs) can provide property profiles than cannot be obtained individually by polymers or nanoparticles (NPs). Here, we have studied the mixing--demixing transition of symmetric copolymer melts of…

Soft Condensed Matter · Physics 2020-01-23 Peter Yatsyshin , Nikolaos G. Fytas , Panagiotis E. Theodorakis

Graphene nanoribbons show exciting electronic properties related to the exotic nature of the charge carriers and to local confinement as well as atomic-scale structural details. The local work function provides evidence for such structural,…

Mesoscale and Nanoscale Physics · Physics 2024-09-25 D. Rothhardt , A. Kimouche , T. Klamroth , R. Hoffmann-Vogel

We report an electron transport study of lithographically fabricated graphene nanoribbons of various widths and lengths at different temperatures. At the charge neutrality point, a length-independent transport gap forms whose size is…

Mesoscale and Nanoscale Physics · Physics 2015-05-14 Melinda Y. Han , Juliana C. Brant , Philip Kim

Making devices with graphene necessarily involves making contacts with metals. We use density functional theory to study how graphene is doped by adsorption on metal substrates and find that weak bonding on Al, Ag, Cu, Au and Pt, while…

Materials Science · Physics 2009-11-13 G. Giovannetti , P. A. Khomyakov , G. Brocks , V. M. Karpan , J. van den Brink , P. J. Kelly

We report the results of molecular dynamics simulations of the properties of a pseudo-atom model of dodecane thiol ligated 5-nm diameter gold nanoparticles (AuNP) in vacuum as a function of ligand coverage and particle separation in three…

Chemical Physics · Physics 2019-02-20 Christopher Liepold , Alex Smith , Binhua Lin , Juan de Pablo , Stuart A. Rice

Graphene-based nanofolds (GNFs) are edge-connected 2D stacked monolayers originated from single-layer graphene. Graphene-based nanoscrolls (GNSs) are nanomaterials with geometry resembling graphene layers rolled up into a spiral…

Materials Science · Physics 2021-09-23 Marcelo Lopes Pereira Junior , Luiz Antonio Ribeiro Junior