Bioactive Sol-Gel Glasses at the Atomic Scale: The Complementary Use of Advanced Probe and Computer Modeling Methods

A multinuclear solid state NMR spectroscopic study of the structural evolution of disordered calcium silicate sol–gel biomaterials

(2015) Zhongjie Lin et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Atomic-scale models of early-stage alkali depletion and SiO2-rich gel formation in bioactive glasses

(2015) Antonio Tilocca   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Probing the fate of interstitial water in bulk bioactive glass by ab initio simulations

(2014) Enrico Berardo et al.   RSC Advances

NXFit: a program for simultaneously fitting X-ray and neutron diffraction pair-distribution functions to provide optimized structural parameters

(2014) David Pickup et al.   JOURNAL OF APPLIED CRYSTALLOGRAPHY

Hydration Effects on the Structural and Vibrational Properties of Yttrium Aluminosilicate Glasses for in Situ Radiotherapy

(2013) Jahangir Malik et al.   JOURNAL OF PHYSICAL CHEMISTRY B

First-Principles Calculation of NMR Parameters Using the Gauge Including Projector Augmented Wave Method: A Chemist’s Point of View

(2012) Christian Bonhomme et al.   CHEMICAL REVIEWS

An examination of the calcium and strontium site distribution in bioactive glasses through isomorphic neutron diffraction, X-ray diffraction, EXAFS and multinuclear solid state NMR

(2012) R. A. Martin et al.   JOURNAL OF MATERIALS CHEMISTRY

Effect of Calcium Source on Structure and Properties of Sol–Gel Derived Bioactive Glasses

(2012) Bobo Yu et al.   LANGMUIR

Effect of Strontium Substitution on the Structure of 45S5 Bioglasses

(2011) Ye Xiang et al.   CHEMISTRY OF MATERIALS

Fluorine Environment in Bioactive Glasses:ab InitioMolecular Dynamics Simulations

(2011) Jamieson K. Christie et al.   JOURNAL OF PHYSICAL CHEMISTRY B

The PAW/GIPAW approach for computing NMR parameters: A new dimension added to NMR study of solids

(2011) Thibault Charpentier   SOLID STATE NUCLEAR MAGNETIC RESONANCE

Aluminosilicate Glasses As Yttrium Vectors for in situ Radiotherapy: Understanding Composition-Durability Effects through Molecular Dynamics Simulations

(2010) Jamieson K. Christie et al.   CHEMISTRY OF MATERIALS

Modeling the Water−Bioglass Interface by Ab Initio Molecular Dynamics Simulations

(2009) Antonio Tilocca et al.   ACS Applied Materials & Interfaces

Nanostructure evolution and calcium distribution in sol–gel derived bioactive glass

(2009) Sen Lin et al.   JOURNAL OF MATERIALS CHEMISTRY

Characterisation of the inhomogeneity of sol–gel-derived SiO2–CaO bioactive glass and a strategy for its improvement

(2009) Sen Lin et al.   JOURNAL OF SOL-GEL SCIENCE AND TECHNOLOGY

Elucidation of the Structural Role of Fluorine in Potentially Bioactive Glasses by Experimental and Computational Investigation

(2008) G. Lusvardi et al.   JOURNAL OF PHYSICAL CHEMISTRY B