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The hydrogen-bond network of water is characterized by the presence of coordination defects relative to the ideal tetrahedral network of ice, whose fluctuations determine the static and time-dependent properties of the liquid. Because of…

Chemical Physics · Physics 2016-06-06 Piero Gasparotto , Ali A. Hassanali , Michele Ceriotti

Most elemental metals under ambient conditions adopt simple structures such as BCC, FCC and HCP in specific groupings across the Periodic Table, and on compression, many of these elements undergo transitions to surprisingly complex…

Materials Science · Physics 2022-06-27 Yuanhui Sun , Lei Zhao , Chris J. Pickard , Russell J. Hemley , Yonghao Zheng , Maosheng Miao

Stacking mismatches in hexagonal boron nitride (h-BN) nanostructures affect their photonic, mechanical, and thermal properties. To access information about the stacked configuration of layered ensembles, highly sophisticated techniques like…

Materials Science · Physics 2021-03-03 Luigi Cigarini , Michal Novotný , František Karlický

Collective optical excitations, such as localized surface plasmons in metallic nanoparticles and Mie resonances in high-index dielectrics, play a central role in nanoscale light--matter interactions. When such optical modes interact with…

Differentiating structural evolution from structural development or formation opens many avenues of research. The study particularly advances the chemical and physical sciences, material science, energy science, and chemical engineering. By…

Materials Science · Physics 2025-12-30 Mubarak Ali

Nanoparticles (NPs) make for intriguing heterogeneous catalysts due to their large active surface area and excellent and often size-dependent catalytic properties that emerge from a multitude of chemically different surface reaction sites.…

Metallic nanoclusters displaying electronic shell structure exhibit the special feature of a correlation between their geometry and the number of delocalized electrons . Their shape evolution can be described as a quantum oscillation…

Atomic and Molecular Clusters · Physics 2008-04-04 Vladimir Kresin

A new approach for describing the effective electronic states of "atoms in compounds" to study the properties of molecules and condensed matter which are circumscribed by the operators heavily concentrated in atomic cores is proposed. Among…

Chemical Physics · Physics 2014-12-02 Anatoly V. Titov , Yuriy V. Lomachuk , Leonid V. Skripnikov

Defects in the multi-dimensional macroscopic quantum field of the He-3 superfluids are localized objects with a topological charge and are topologically stable. They include point-like objects, vortex lines, planar domain-wall-like…

Condensed Matter · Physics 2007-05-23 V. B. Eltsov , M. Krusius

Crystallography typically studies collections of point particles whose interaction forces are the gradient of a potential. Lifting this assumption generically gives rise in the continuum limit to a form of elasticity with additional moduli…

Soft Condensed Matter · Physics 2021-12-30 Lara Braverman , Colin Scheibner , Bryan VanSaders , Vincenzo Vitelli

Motivated by the need for less destructive imaging of nanostructures, we pursue point-source in-line holography (also known as point projection microscopy, or PPM) with very low energy electrons (-100 eV). This technique exploits the recent…

Materials Science · Physics 2015-05-27 Lucian Livadaru , Josh Mutus , Robert A. Wolkow

Hyperbolic metamaterials (HMMs) offer unconventional properties in the field of optics, enabling opportunities for confinement and propagation of light at the nanoscale. In-plane orientation of the optical axis, in the direction coinciding…

Materials Science · Physics 2021-03-09 I. Murataj , M. Channab , E. Cara , C. F. Pirri , L. Boarino , A. Angelini , F. Ferrarese Lupi

Flat band materials such as the kagome metals or moir\'e superlattice systems are of intense current interest. Flat bands can result from the electron motion on numerous (special) lattices and usually exhibit topological properties. Their…

Strongly Correlated Electrons · Physics 2024-05-28 Joseph G. Checkelsky , B. Andrei Bernevig , Piers Coleman , Qimiao Si , Silke Paschen

In metal nanoparticles (NPs) supracrystals, the metallic core provides some key properties, e.g. magnetization, plasmonic response or conductivity, with the ligand molecules giving rise to others like solubility, assembly or interaction…

Vertical integration of two-dimensional materials has recently emerged as an exciting method for the design of novel electronic and optoelectronic devices. Using density functional theory, we investigatethe structural and electronic…

Materials Science · Physics 2015-06-25 Yongqing Cai , Gang Zhang , Yong-Wei Zhang

We consider hole pairing in the pseudopgap phase of High T_c cuprates, as arising from resonant scattering on dynamically deformable molecular units. As a result, localized and delocalized features coexist in the one-particle spectra: the…

Superconductivity · Physics 2009-04-20 J. Ranninger , T. Domanski

The feature of interaction electrons with neutral matter attracts large attention of physicists many directions. The exchange interaction in particular leads to creating of bubbles - spherical cavities with electron in center. Good object…

Mesoscale and Nanoscale Physics · Physics 2014-02-07 A. V. Smorodin , V. A. Nikolaenko

Defect engineering offers an important route to property tuning of nanostructured coatings for advanced applications. Transition metal nitrides, such as CrN, are widely used for their mechanical resilience, but their nitrogen-rich analogue…

Materials Science · Physics 2025-10-08 Barsha Bhattacharjee , Emilia Olsson

We adopt an atomistic pseudopotential description of the electronic structure of self-assembled, lens shaped InAs quantum dots within the ``linear combination of bulk bands'' method. We present a detailed comparison with experiment,…

Materials Science · Physics 2009-10-31 A. J. Williamson , L. W. Wang , Alex Zunger

Recent advances in scanning transmission electron and scanning tunneling microscopies allow researchers to measure materials structural and electronic properties, such as atomic displacements and charge density modulations, at an Angstrom…

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