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Protein-surface interactions are ubiquitous in biological processes and bioengineering, yet are not fully understood. In biosensors, a key factor determining the sensitivity and thus the performance of the device is the orientation of the…

Biological Physics · Physics 2016-04-12 Christopher D. Cooper , Natalia C. Clementi , Lorena A. Barba

Multilayered heterostructures of Ce0.85Sm0.15O2-delta and Y0.16Zr0.92O2-delta of a high crystallographic quality were fabricated on (001) - oriented MgO single crystal substrates. Keeping the total thickness of the heterostructures…

Zirconium nitride (ZrN) is a refractory material with good mechanical and thermal properties. It is therefore a good candidate for hard surface treatment at high temperature. In this work, we report the growth and characterization of ZrN by…

Materials Science · Physics 2025-05-13 Luc Pichon , A. Straboni , T. Girardeau , M. Drouet , P. Widmayer

A comparative classification scheme provides a good basis for several approaches to understand proteins, including prediction of relations between their structure and biological function. But it remains a challenge to combine a…

Biomolecules · Quantitative Biology 2015-05-20 Shuangwei Hu , Andrei Krokhotin , Antti J. Niemi , Xubiao Peng

Systematic exploration of amorphous ABC heterostructures revealed that nanoscale morphological modifications markedly improved their artificial bulk second-order susceptibility. These amorphous birefringent heterostructures were fabricated…

Micro-/nano-indentations have been widely used to measure the mechanical properties of biological cells and tissues, but direct application of classical Hertzian contact model would lead to overestimation of elastic modulus due to the…

Materials Science · Physics 2018-10-29 Yue Ding , Wei-Ke Yuan , Gang-Feng Wang

The integration of coherent emitters into low-loss photonic circuits is a key technology for quantum networking. In this context, nanophotonic silicon devices implanted with erbium are a promising hardware platform that combines advanced…

We propose a self-consistent model taking into account variations in adsorption properties of the adsorbent surface in the process of adsorption--desorption of molecules of gas on it. We introduce a dimensionless coupling parameter that…

Materials Science · Physics 2009-11-30 A. S. Usenko

The results of fabrication and characterization of atomic structure of nanocrystalline thin layers of Y2O3 in cubic and monoclinic phases is reported. Experimental data demonstrate crystalline ordering in nanocrystalline films with average…

Materials Science · Physics 2022-12-28 D. W. Boukhvalov , D. A. Zatsepin , Yu. A. Kuznetsova , N. V. Gavrilov , A. F. Zatsepin

We recently introduced a physical model [Hoang et al., P. Natl. Acad. Sci. USA (2004), Banavar et al., Phys. Rev. E (2004)] for proteins which incorporates, in an approximate manner, several key features such as the inherent anisotropy of a…

Biomolecules · Quantitative Biology 2007-05-23 Trinh X. Hoang , Antonio Trovato , Flavio Seno , Jayanth R. Banavar , Amos Maritan

Nanoparticle sintering remains a critical challenge in heterogeneous catalysis. In this work, we present a unified deep potential (DP) model for Cu nanoparticles on three Al$_2$O$_3$ surfaces ($\gamma$-Al$_2$O$_3$(100),…

Materials Science · Physics 2025-01-30 Jiayan Xu , Shreeja Das , Amar Deep Pathak , Abhirup Patra , Sharan Shetty , Detlef Hohl , Roberto Car

Thin films of undoped zinc oxide (ZnO) and doped ZnO with copper were deposited on ceramic pellets made from abundant local clay materials with an addition of zirconia (ZrO2). The thin layers were prepared by a thermal method using an…

Chemical Physics · Physics 2018-08-22 D. Bouras , A. Mecif , R. Barillé , A. Harabi , M. Rasheed , A. Mahdjoub , M. Zaabat

We perform nanoindentation simulations for both the prototypical face-centered cubic metal copper and the body-centered cubic metal tungsten with a new adaptive-precision description of interaction potentials including different accuracy…

Materials Science · Physics 2025-09-30 David Immel , Matous Mrovec , Ralf Drautz , Godehard Sutmann

We present a model, based on symmetry and geometry, for proteins. Using elementary ideas from mathematics and physics, we derive the geometries of discrete helices and sheets. We postulate a compatible solvent-mediated emergent pairwise…

Soft Condensed Matter · Physics 2023-06-21 Jayanth R. Banavar , Achille Giacometti , Trinh X. Hoang , Amos Maritan , Tatjana Škrbić

Whereas ferroelectricity may vanish in ultra-thin ferroelectric films, it is expected to emerge in ultra-thin anti-ferroelectric films, sparking people's interest in using antiferroelectric materials as an alternative to ferroelectric ones…

Chemisorption process and catalytic activity of CO to CO2 conversion on PdXRu1-X (X : 0, 0.1, 0.3, 0.5, 0.7, 0.9 and 1) extended as a benchmark for further investigation of very complex nanoparticle (NP) structures have been checked into…

Demand for artificial body implants has been on the rise over the years. However, wear and bacterial infection are identified as two major reasons that can lead to inflammation and implant failure. In this communication, the advantages of…

Biological Physics · Physics 2022-07-27 S. Kedia , A. Das , B. S. Patro , J. P. Nilaya

Chemisorption of CO on the stepped Cu(211) surface is studied within ab-initio density functional theory (DFT) and scanning tunneling microscopy (STM) imaging as well as manipulation experiments. Theoretically we focus on the experimentally…

Materials Science · Physics 2009-11-10 Marek Gajdos , Andreas Eichler , Jurgen Hafner , Gerhard Meyer , Karl-Heinz Rieder

Engineered inorganic nanoparticles are essential components in the development of nanotechnologies. For applications in nanomedicine, particles need to be functionalized to ensure a good dispersibility in biological fluids. In many cases…

Materials Science · Physics 2011-08-25 M. Safi , J. Courtois , M. Seigneuret , H. Conjeaud , J. -F. Berret

There are large number of proteins, the existence of which are known but not their crystal structure, because of difficulty in finding the exact condition for their crystallization. Heterogeneous nucleation on disordered porous substrates…

Biological Physics · Physics 2015-10-19 Anindita Sengupta Ghatak , Animangsu Ghatak