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In hydrogenated amorphous silicon oxide (a-SiO:H) films, incorporation of oxygen enhances optical gap due to a large number of St-O-Si bond formation, which lies deep into valence band states. An induction effect of this Si-O on other bonds…

Condensed Matter · Physics 2007-11-17 S. M. Iftiquar

Fluids confined in nanopores exhibit properties different from the properties of the same fluids in bulk, among these properties are the isothermal compressibility or elastic modulus. The modulus of a fluid in nanopores can be extracted…

Chemical Physics · Physics 2018-03-14 Christopher D. Dobrzanski , Max A. Maximov , Gennady Y. Gor

We analyse a binary mixture of colloidal parallel hard cylindrical particles with identical diameters but dissimilar lengths $L_1$ and $L_2$, with $s=L_2/L_1=3$, confined by two parallel hard walls in a planar slit-pore geometry, using a…

Soft Condensed Matter · Physics 2019-03-27 Daniel de las Heras , Yuri Martinez-Raton , Enrique Velasco

Second harmonic generation (SHG) spectroscopy has been applied to probe the fused silica/water interface at pH 7 and the uncharged 11bar02 sapphire/water interface at pH 5.2 in contact with aqueous solutions of NaCl, NaBr, NaI, KCl, RbCl,…

Materials Science · Physics 2018-03-28 Mavis D. Boamah , Paul E. Ohno , Franz M. Geiger , Kenneth B. Eisenthal

Sum frequency generation vibrational spectra of the water molecules at the NaF and KF aqueous solution surfaces showed significantly different spectral features and different concentration dependence. This result is the first direct…

Chemical Physics · Physics 2016-08-29 Ran-ran Feng , Hong-tao Bian , Yuan Guo , Hong-fei Wang*

Vibrational spectroscopy is key for probing the interplay between the structure and dynamics of aqueous systems. In order to map different regions of experimental spectra to the microscopic structure of a system, it is important to combine…

Chemical Physics · Physics 2021-08-09 Sam Shepherd , Jinggang Lan , David M. Wilkins , Venkat Kapil

A combination of the temporally and spatially resolved phonon spectroscopy has enabled calibration of hydrogen bond transition from the vibration mode of heavy water to the core/shelled nanodroplet and the subnanosized ionic hydration shell…

Chemical Physics · Physics 2018-11-30 Chang Q Sun

Nanoconfined water plays an indispensable role in various phenomena in biology, chemistry, and engineering. It exhibits many abnormal properties compared to bulk water, especially under strong confinement. However, the origin of those…

In 2004, Kim and Chan (KC) carried out torsional oscillator (TO) measurements of solid helium confined in porous Vycor glass and found an abrupt drop in the resonant period below 200 mK. The period drop was interpreted as probable…

Other Condensed Matter · Physics 2013-05-30 Duk Y. Kim , Moses H. W. Chan

In this work, the vibrational dynamics and spectroscopy of deuterated water molecules (D$_{2}$O) mimicking dense water layers at room temperature on the surfaces of two different C/N based materials with different N content and pore size,…

Chemical Physics · Physics 2024-03-12 Deepak Ojha , Christopher Penschke , Peter Saalfrank

We study the wetting properties of water on silica surfaces using molecular dynamics (MD) simulations. To describe the intermolecular interaction between water and silica atoms, two types of interaction potential models are used: the…

Soft Condensed Matter · Physics 2016-10-12 E. Pafong , J. Geske , B. Drossel

The fundamental understanding of water confined in porous coordination polymers (PCPs) is significantly important not only for their applications such as gas storage and separation, but also for exploring the confinement effects in the…

We use molecular dynamics computer simulations and nuclear magnetic resonance experiments to investigate the dynamics of water at interfaces of molecular roughness and low mobility. We find that, when approaching such interfaces, the…

Soft Condensed Matter · Physics 2014-07-22 Markus Rosenstihl , Kerstin Kämpf , Felix Klameth , Matthias Sattig , Michael Vogel

A combined experimental/theoretical approach has been used to investigate the role of water in modifying the microscopic interactions characterizing the optical response of butyl-ammonium nitrate (BAN) water solutions. Raman spectra,…

This study investigates the interplay between Strong Coupling (SC) attraction and hydration repulsion in nanoconfined water between like-charged phospholipid layers. It challenges the assumption that SC attraction requires multivalent…

Molecular dynamics simulations of supercritical water reveal distinctly different distance-dependent modulations of dipolar response and correlations in particle motion compared to ambient conditions. The strongly perturbed H-bond network…

Chemical Physics · Physics 2021-04-15 Maciej Śmiechowsk , Christoph Schran , Harald Forbert , Dominik Marx

The loss factor of supercooled water at the frequencies 11...180 GHz has been measured. A measuring technique has been proposed, in which wetted nanoporous silicate materials, silica gels, with the mean diameter of the pores being 6-9 nm,…

Soft Condensed Matter · Physics 2019-01-15 G. S. Bordonskiy , A. O. Orlov

We perform systematic molecular dynamics simulations of water confined between two nanoscale plates at T=300 K. We investigate the effect of pressure (-0.15 GPa <= P <= 0.2 GPa) and plate separation (0.4 nm <= d <= 1.6 nm) on the phase…

Chemical Physics · Physics 2016-09-08 Nicolas Giovambattista , Peter J. Rossky , Pablo G. Debenedetti

We investigate whether an interpretation of water's thermodynamics [Science, 319, 582 (2008)] by using analogy with the binary metal alloys lambda-type ordering transition or buckminsterfullerene's orientational-ordering transition has…

Soft Condensed Matter · Physics 2008-07-01 Francesco Mallamace , Elpidio Tombari , Giuseppe Salvetti , Gyan P. Johari

We report an analysis of the stretching peak appearing in the IR experimental spectra of liquid water. In the literature, ATR-IR spectroscopic measurements were repeatedly performed in a wide range of temperature and gave rise to a lively…

Soft Condensed Matter · Physics 2013-10-03 A. De Ninno , E. Del Giudice , L. Gamberale , A. Congiu Castellano