نتایج جستجو برای: van der waals model

تعداد نتایج: 2290763  

Journal: :Nature communications 2016
Naoto Yabuki Rai Moriya Miho Arai Yohta Sata Sei Morikawa Satoru Masubuchi Tomoki Machida

Supercurrent flow between two superconductors with different order parameters, a phenomenon known as the Josephson effect, can be achieved by inserting a non-superconducting material between two superconductors to decouple their wavefunctions. These Josephson junctions have been employed in fields ranging from digital to quantum electronics, yet their functionality is limited by the interface q...

2014
Per Hyldgaard Kristian Berland Elsebeth Schröder

The nonlocal correlation energy in the van der Waals density functional (vdW-DF) method can be interpreted in terms of a coupling of zero-point energies of characteristic modes of semilocal exchange-correlation (xc) holes. These xc holes reflect the internal functional in the framework of the vdW-DF method. We explore the internal xc hole components, showing that they share properties with thos...

Journal: :Journal of the mechanical behavior of biomedical materials 2011
Qing Luo Rugved Nakade Xuanliang Dong Qiguo Rong Xiaodu Wang

The interactions between mineral and collagen phases in the ultrastructural level play an important role in determining the mechanical properties of bone tissue. Three types of mineral-collagen interaction (i.e., ionic interactions, hydrogen/van der Waals bonds, and van der Waals/viscous shear in opening/sliding mode, respectively) have been simulated in this study, using cohesive zone-modeling...

Journal: :The journal of physical chemistry. A 2006
Yan Zhao Donald G Truhlar

Recent interest in the application of density functional theory prompted us to test various functionals for the van der Waals interactions in the rare-gas dimers, the alkaline-earth metal dimers, zinc dimer, and zinc-rare-gas dimers. In the present study, we report such tests for 18 DFT functionals, including both some very recent functionals and some well-established older ones. We draw the fo...

2005
S. Capozziello V. F. Cardone S. Carloni S. De Martino M. Falanga A. Troisi M. Bruni

We discuss an alternative approach to quintessence modifying the usual equation of state of the cosmological fluid in order to see if going further than the approximation of perfect fluid allows to better reproduce the available data. We consider a cosmological model comprising only two fluids, namely baryons (modelled as dust) and dark matter with a Van der Waals equation of state. First, the ...

Journal: :Nano letters 2015
Akihiro Kushima Xiaofeng Qian Peng Zhao Sulin Zhang Ju Li

Dislocations are topological line defects in three-dimensional crystals. Same-sign dislocations repel according to Frank's rule |b1 + b2|(2) > |b1|(2) + |b2|(2). This rule is broken for dislocations in van der Waals (vdW) layers, which possess crystallographic Burgers vector as ordinary dislocations but feature "surface ripples" due to the ease of bending and weak vdW adhesion of the atomic lay...

2009
William G. Hoover

The quantitative thermodynamic effect of adding a weak, long-range attraction to inverse-power repUlsive potentials is studied. The resulting phase diagrams exhibit two fluid phases and a solid phase. a critical point, a triple point, and, for sufficiently soft repulsions, an additional solid phase with an additional triple point. The effects of attractions other than van der Waals' are studied...

In this letter, we consider static black hole in f(R) gravity.We take advantage from corrected entropy and temperature and investigate such black hole. Finally, we study the $ P - V $ critically and phase transition of corrected black hole with respect to entropy and temperature. Here also, we obtain the heat capacity for the static black hole in $ f(R) $ gravity. This calculation help us...

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