Where is the most hydrophobic region? Benzopurpurine self-assembly at the calcite-water interface

QR Code

Where is the most hydrophobic region? Benzopurpurine self-assembly at the calcite-water interface

© 2017 American Chemical Society. Control of molecular self-Assembly at solid- liquid interfaces is challenging due to the complex interplay between molecule-molecule, molecule-surface, molecule- solvent, surface-solvent, and solvent-solvent interactions. Here, we use in-situ dynamic atomic force mi...

Full description

Bibliographic Details
Main Authors:	Nalbach, M., Raiteri, Paolo, Klassen, S., Schäfer, S., Gale, J., Bechstein, R., Kühnle, A.
Format:	Journal Article
Published:	American Chemical Society 2017
Online Access:	http://purl.org/au-research/grants/arc/DP160100677 http://hdl.handle.net/20.500.11937/58477

Similar Items

Does the Structural Water within Gypsum Remain Crystalline at the Aqueous Interface?
by: Söngen, H., et al.
Published: (2021)

Resolving Point Defects in the Hydration Structure of Calcite (10.4) with Three-Dimensional Atomic Force Microscopy
by: Söngen, H., et al.
Published: (2018)

Is the calcite–water interface understood?: Direct comparisons of molecular dynamics simulations with specular x-ray reflectivity data
by: Fenter, P., et al.
Published: (2012)

Derivation of an Accurate Force-Field for Simulating the Growth of Calcium Carbonate from Aqueous Solution: A New Model for the Calcite-Water Interface
by: Raiteri, Paolo, et al.
Published: (2010)

Rates and mechanisms of calcite growth and its inhibition by strontium
by: Stack, A., et al.
Published: (2012)

Uncovering the Atomistic Mechanism for Calcite Step Growth.
by: De La Pierre, Marco, et al.
Published: (2017)

Determining the reactivity of steps at the calcite-water interface from computer simulation
by: De la Pierre, M., et al.
Published: (2018)

Structure and Dynamics of Water at Step Edges on the Calcite {101̅4} Surface
by: De La Pierre, Marco, et al.
Published: (2016)

Atomistic Simulation of Atomic Force Microscopy Imaging of Hydration Layers on Calcite, Dolomite, and Magnesite Surfaces
by: Reischl, Bernhard, et al.
Published: (2019)

Molecular dynamics simulations of liquid-liquid interfaces in an electric field: The water-1,2-dichloroethane interface
by: Raiteri, Paolo, et al.
Published: (2020)

Determining the Complete Stability of Calcite Kink Sites: Real vs Ideal
by: Armstrong, Blake I., et al.
Published: (2023)

Virtual Probes of Mineral–Water Interfaces: The More Flops, the Better!
by: Stack, A., et al.
Published: (2013)

Wetting Properties of the CO2-Water-Calcite System via Molecular Simulations: Shape and Size Effects
by: Silvestri, Alessandro, et al.
Published: (2019)

Determining the Adsorption Free Energies of Small Organic Molecules and Intrinsic Ions at the Terrace and Steps of Calcite
by: Aufort, Julie, et al.
Published: (2022)

Simulation of proton exchange at the mineral water interface
by: Raiteri, Paolo, et al.
Published: (2014)

Calcite (104) Surface-Electrolyte Structure: A 3D Comparison of Surface X-ray Diffraction and Simulations
by: Brugman, S.J.T., et al.
Published: (2020)

A quantum mechanically derived force field to predict CO2Adsorption on calcite {10.4} in an aqueous environment
by: Silvestri, A., et al.
Published: (2017)

Super-hydrophobic/icephobic coatings based on silica nanoparticles modified by self-assembled monolayers
by: Liu, Junpeng, et al.
Published: (2016)

Assembly line productivity improvement as re-engineered by MOST
by: Karim, A.N. Mustafizul, et al.
Published: (2016)

The mineral-water interface: Where minerals react with the environment
by: Putnis, Christine, et al.
Published: (2013)

Visualizing Organophosphate Precipitation at the Calcite-Water Interface by in Situ Atomic-Force Microscopy
by: Wang, L., et al.
Published: (2016)

Influence of hydrophobic tail on the adsorption of isomeric alkanols at air/water interface
by: Le, Ngoc Thu, et al.
Published: (2009)

Influence of hydrophobic tail on the adsorption of isomeric alcohols at air/water interface
by: Thu, Le, et al.
Published: (2012)

Self-Assembling of Zinc Phthalocyanines on ZnO (1010) Surface through Multiple Time Scales
by: Melis, C., et al.
Published: (2011)

Dynamic electrowetting and dewetting of ionic liquids at a hydrophobic solid-liquid interface
by: Li, H., et al.
Published: (2013)

Do Charitable Foundations Spend Money Where People Need It Most? A Spatial Analysis of China
by: Song, Yongze, et al.
Published: (2018)

Understanding city-regional cooperation: What works where
by: Newman, Peter
Published: (2009)

Water Is the Key to Nonclassical Nucleation of Amorphous Calcium Carbonate
by: Raiteri, Paolo, et al.
Published: (2010)

Tip dependence of three-dimensional scanning force microscopy images of calcite-water interfaces investigated by simulation and experiments
by: Miyazawa, K., et al.
Published: (2020)

Posner's cluster revisited: Direct imaging of nucleation and growth of nanoscale calcium phosphate clusters at the calcite-water interface
by: Wang, L., et al.
Published: (2012)

The atomic structure and dynamics at the CaCO3 vaterite-water interface: A classical molecular dynamics study
by: Schuitemaker, Alicia, et al.
Published: (2021)

On-water Electrochemistry: A Study of Local Current Densities and Ion Transport at the Electrified Hydrophobic–Aqueous Interface
by: Rodriguez, Harry Morris
Published: (2024)

Strain-induced segmentation of magnesian calcite thin films growing on a calcite substrate
by: Sethmann, I., et al.
Published: (2010)

Firefighters and Cancer: Where Are We and Where To Now?
by: Fritschi, Lin, et al.
Published: (2014)

A thermodynamic adsorption/entrapment model for selenium(IV) coprecipitation with calcite
by: Heberling, F., et al.
Published: (2014)

Fabrication of large-area, transferable colloidal monolayers utilizing self-assembly at the air/water interface
by: Retsch, M., et al.
Published: (2009)

Simulation of the thermodynamics of surfaces and interfaces
by: Gale, Julian
Published: (2011)

Ab Initio Modelling of the Structure and Properties of Crystalline Calcium Carbonate
by: Demichelis, Raffaella, et al.
Published: (2016)

Ion Pairing and Multiple Ion Binding in Calcium Carbonate Solutions Based on a Polarizable AMOEBA Force Field and Ab Initio Molecular Dynamics
by: Raiteri, Paolo, et al.
Published: (2020)

Computational Insights into Mg2+ Dehydration in the Presence of Carbonate
by: Aufort, Julie, et al.
Published: (2022)