Surface reconstruction of fluorites in vacuum and aqueous environment

Soft-Sphere Continuum Solvation in Electronic-Structure Calculations

(2017) Giuseppe Fisicaro et al.   Journal of Chemical Theory and Computation

Influence of ions on two-dimensional and three-dimensional atomic force microscopy at fluorite–water interfaces

(2017) K Miyazawa et al.   NANOTECHNOLOGY

A generalized Poisson and Poisson-Boltzmann solver for electrostatic environments

(2016) G. Fisicaro et al.   JOURNAL OF CHEMICAL PHYSICS

Water orientation and hydrogen-bond structure at the fluorite/water interface

(2016) Rémi Khatib et al.   Scientific Reports

The enigma of fluorite morphology revisited by dissolution experiments

(2015) Walter A. Franke   EUROPEAN JOURNAL OF MINERALOGY

Wetting of selected fluorite surfaces by water

(2015) Xia Zhang et al.   Surface Innovations

Solid Electrolytes for Fluoride Ion Batteries: Ionic Conductivity in Polycrystalline Tysonite-Type Fluorides

(2014) Carine Rongeat et al.   ACS Applied Materials & Interfaces

Minima hopping guided path search: An efficient method for finding complex chemical reaction pathways

(2014) Bastian Schaefer et al.   JOURNAL OF CHEMICAL PHYSICS

Preparation and optimization of calcium fluoride particles for dental applications

(2014) Joachim Koeser et al.   JOURNAL OF MATERIALS SCIENCE-MATERIALS IN MEDICINE

Why Mineral Interfaces Matter

(2014) A. Putnis   SCIENCE

The Mineral-Water Interface: Where Minerals React with the Environment

(2013) C. V. Putnis et al.   Elements

Atomic-Scale Processes at the Fluorite–Water Interface Visualized by Frequency Modulation Atomic Force Microscopy

(2013) Naritaka Kobayashi et al.   Journal of Physical Chemistry C

Nanostructured Fluorite-Type Fluorides As Electrolytes for Fluoride Ion Batteries

(2013) Carine Rongeat et al.   Journal of Physical Chemistry C

Conducting Boron Sheets Formed by the Reconstruction of theα-Boron (111) Surface

(2013) Maximilian Amsler et al.   PHYSICAL REVIEW LETTERS

Libxc: A library of exchange and correlation functionals for density functional theory

(2012) Miguel A.L. Marques et al.   COMPUTER PHYSICS COMMUNICATIONS

Nanocomposite containing CaF2 nanoparticles: Thermal cycling, wear and long-term water-aging

(2012) Michael D. Weir et al.   DENTAL MATERIALS

Long-term mechanical durability of dental nanocomposites containing amorphous calcium phosphate nanoparticles

(2012) Jennifer L. Moreau et al.   JOURNAL OF BIOMEDICAL MATERIALS RESEARCH PART B-APPLIED BIOMATERIALS

Microwave-assisted synthesis and characterization of hierarchically structured calcium fluoride

(2012) Zhenxing Yang et al.   MATERIALS RESEARCH BULLETIN

Batteries based on fluoride shuttle

(2011) M. Anji Reddy et al.   JOURNAL OF MATERIALS CHEMISTRY

Role of water in atomic resolution AFM in solutions

(2011) Matthew Watkins et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Daubechies wavelets for high performance electronic structure calculations: The BigDFT project

(2010) Luigi Genovese et al.   COMPTES RENDUS MECANIQUE

Crystal structure prediction using the minima hopping method

(2010) Maximilian Amsler et al.   JOURNAL OF CHEMICAL PHYSICS

Direct mapping of the solid–liquid adhesion energy with subnanometre resolution

(2010) Kislon Voïtchovsky et al.   Nature Nanotechnology

Mechanism of Contrast Formation in Atomic Force Microscopy in Water

(2010) Matthew Watkins et al.   PHYSICAL REVIEW LETTERS

Adsorption of small NaCl clusters on surfaces of silicon nanostructures

(2009) Maximilian Amsler et al.   NANOTECHNOLOGY

An investigation into the mechanism of the three-phase contact formation at fluorite surface by colliding bubble

(2008) J. Zawala et al.   INTERNATIONAL JOURNAL OF MINERAL PROCESSING

Daubechies wavelets as a basis set for density functional pseudopotential calculations

(2008) Luigi Genovese et al.   JOURNAL OF CHEMICAL PHYSICS

Bell-Evans-Polanyi principle for molecular dynamics trajectories and its implications for global optimization

(2008) Shantanu Roy et al.   PHYSICAL REVIEW E

Ubiquitous Mechanisms of Energy Dissipation in Noncontact Atomic Force Microscopy

(2008) S. Alireza Ghasemi et al.   PHYSICAL REVIEW LETTERS