Surface chemical heterogeneity modulates silica surface hydration (original) (raw)

Cooperative effects at water–crystalline silica interfaces strengthen surface silanol hydrogen bonding. An ab initio molecular dynamics study

Mariona Sodupe

Physical Chemistry Chemical Physics, 2012

View PDFchevron_right

Chemically Modified Silica Materials as Model Systems for the Characterization of Water-Surface Interactions

BHARTI KUMARI

Zeitschrift für Physikalische Chemie, 2018

View PDFchevron_right

The amorphous silica-liquid water interface studied by ab initio molecular dynamics (AIMD): local organization in global disorder

Frederik Tielens

Journal of physics. Condensed matter : an Institute of Physics journal, 2014

View PDFchevron_right

Evaluation of silica-water surface chemistry using NMR spectroscopy

William Bourcier

Geochimica et Cosmochimica Acta, 2002

View PDFchevron_right

Elucidating the bimodal acid-base behavior of the water-silica interface from first principles

Kevin Leung

Journal of the American Chemical Society, 2009

View PDFchevron_right

Probing the chemistry, structure, and dynamics of the water-silica interface

Stephen Garofalini

2013

View PDFchevron_right

Thermodynamics of hydrophobic interaction between silica surfaces coated with octadecyltrichlorosilane

Roe-Hoan Yoon

Journal of Colloid and Interface Science, 2013

View PDFchevron_right

Polarization model for poorly-organized interfacial water: Hydration forces between silica surfaces

Marian Manciu

Advances in Colloid and Interface Science, 2006

View PDFchevron_right

Ions Tune Interfacial Water Structure and Modulate Hydrophobic Interactions at Silica Surfaces

Eric Borguet

Journal of the American Chemical Society

View PDFchevron_right

Cleavage and Recovery of Molecular Water in Silica

Hannes Jónsson

The Journal of Physical Chemistry B, 2005

View PDFchevron_right

Effects of Short-Chain Alcohols and Pyridine on the Hydration Forces between Silica Surfaces

Roe-Hoan Yoon

Journal of Colloid and Interface Science, 1998

View PDFchevron_right

A reactive molecular dynamics simulation of the silica-water interface

Adri van Duin

The Journal of Chemical Physics, 2010

View PDFchevron_right

Insights into Silica Bilayer Hydroxylation and Dissolution

Martin Sterrer

Topics in Catalysis, 2016

View PDFchevron_right

Parametrizing nonbonded interactions between silica and water from first principles

Murat Barisik

View PDFchevron_right

Surficial siloxane-to-silanol interconversion during room temperature hydration/dehydration of amorphous silica films observed by ATR-IR and TIR-Raman spectroscopies

Susie Warring

View PDFchevron_right

Ab initio study of the hydroxylated surface of amorphous silica: A representative model

Jean-Francois Lambert

Chemistry of …, 2008

View PDFchevron_right

Molecular features of water films created with bubbles at silica surfaces

Xihui Yin

Surface Innovations, 2015

View PDFchevron_right

Influence of the partial hydrophobization of fumed silica by hexamethyldisilazane on interactions with water

Barbara Charmas

Langmuir, 2003

View PDFchevron_right

Changes in the Silanol Protonation State Measured In Situ at the Silica–Aqueous Interface

Mariateresa Scarongella

The Journal of Physical Chemistry Letters, 2012

View PDFchevron_right

Hydrophobicity, Hydrophilicity and Silane Surface Modification

Barry Arkles

Hydrophobicity, Hydrophilicity and Silane Surface Modification, 2011

View PDFchevron_right

Study of the Constitutive Superficial Water of Precipitated Amorphous Silicas using 1 H NMR: Broad-Line at 4 K and HR MAS at 300 K

Jacques Fraissard

Journal of the American Chemical Society, 1996

View PDFchevron_right

Molecular dynamics simulations of water on a hydrophilic silica surface at high air pressures

Richard Jaffe

Journal of Molecular Liquids, 2014

View PDFchevron_right

Water Structure and Dynamics at a Silica Surface: Pake Doublets in 1H NMR Spectra

Willy Nerdal

Langmuir, 2011

View PDFchevron_right

Amphiphilic Silica Nanoparticles at the Decane−Water Interface: Insights from Atomistic Simulations

heng fan

Langmuir, 2011

View PDFchevron_right

Quantum, classical, and multi-scale simulation of silica–water interaction: molecules, clusters, and extended systems

Andrew Kolchin

Journal of Computer-Aided Materials Design, 2006

View PDFchevron_right

Enhanced Hydrolytic Stability of Siliceous Surfaces Modified with Pendant Dipodal Silanes

Mani Singh

Chemistry - A European Journal, 2014

View PDFchevron_right

Structural studies of water in hydrophilic and hydrophobic mesoporous silicas: An x-ray and neutron diffraction study at 297 K

DORBEZ-SRIDI Rachida

View PDFchevron_right

Dynamics and vibrational spectroscopy of water at hydroxylated silica surfaces

Prashant Gupta

Faraday Discussions, 2013

View PDFchevron_right

Investigating the effect of pH on the surface chemistry of an amino silane treated nano silica

mehran rostami

Pigment & Resin Technology, 2011

View PDFchevron_right

Quantitative Assessment of Hydrophilicity/Hydrophobicity in Mesoporous Silica by combining Adsorption, Liquid Intrusion and solid-state NMR spectroscopy

Rustam Durdyyev

View PDFchevron_right