List of works - Pieremanuele Canepa

Affinity of hydroxyapatite (001) and (010) surfaces to formic and alendronic acids: a quantum-mechanical and infrared study.

scientific article

An efficient algorithm for finding the minimum energy path for cation migration in ionic materials

scientific article published in August 2016

Assessing the formation of weak sodium complexes with negatively charged ligands.

scientific article published on 26 April 2016

Atomic-Scale Influence of Grain Boundaries on Li-Ion Conduction in Solid Electrolytes for All-Solid-State Batteries.

scientific article

Comparison of a calculated and measured XANES spectrum of α-Fe2O3

article

Correction to "Atomic-Scale Influence of Grain Boundaries on Li-Ion Conduction in Solid Electrolytes for All-Solid-State Batteries"

scientific article published on 24 May 2018

Diffusion of small molecules in metal organic framework materials

scientific article published on 09 January 2013

Evaluation of sulfur spinel compounds for multivalent battery cathode applications

Fundamentals of inorganic solid-state electrolytes for batteries

scientific article published on 19 August 2019

High magnesium mobility in ternary spinel chalcogenides.

scientific article published on 24 November 2017

J-ICE: a new Jmol interface for handling and visualizing crystallographic and electronic properties

scientific article published on 14 December 2010

Magnesium ion mobility in post-spinels accessible at ambient pressure.

scientific article published on 25 April 2017

Materials Design Rules for Multivalent Ion Mobility in Intercalation Structures

article

Mechanism of Preferential Adsorption of SO2 into Two Microporous Paddle Wheel Frameworks M(bdc)(ted)0.5

NMR study of small molecule adsorption in MOF-74-Mg.

scientific article published in April 2013

Odyssey of Multivalent Cathode Materials: Open Questions and Future Challenges.

scientific article published on 13 February 2017

Particle Morphology and Lithium Segregation to Surfaces of the Li7La3Zr2O12 Solid Electrolyte

scientific article published on 12 April 2018

Role of Structural H2O in Intercalation Electrodes: The Case of Mg in Nanocrystalline Xerogel-V2O5. ⬇️

scientific article published on 16 March 2016

Spectroscopic characterization of van der Waals interactions in a metal organic framework with unsaturated metal centers: MOF-74-Mg

scientific article published on 03 October 2012

Spinel compounds as multivalent battery cathodes: a systematic evaluation based on ab initio calculations

Study of van der Waals bonding and interactions in metal organic framework materials ⬇️

scientific article published on 11 March 2014

Tuning the gate opening pressure of Metal-Organic Frameworks (MOFs) for the selective separation of hydrocarbons

scientific article published on 10 September 2012

Under Pressure: Mechanochemical Effects on Structure and Ion Conduction in the Sodium-Ion Solid Electrolyte Na3PS4

scientific article published on 15 October 2020

Understanding the Structural and Electronic Properties of Bismuth Trihalides and Related Compounds

scientific article published on 28 January 2020

Water cluster confinement and methane adsorption in the hydrophobic cavities of a fluorinated metal-organic framework.

scientific article published on 15 August 2013

List of works by Pieremanuele Canepa