Polarization effects in ionic solids and melts
Ionic solids and melts are compounds in which the interactions are dominated by
electrostatic effects. However, the polarization of the ions also plays an important role in …
electrostatic effects. However, the polarization of the ions also plays an important role in …
Relaxation and physical aging in network glasses: a review
M Micoulaut - Reports on Progress in Physics, 2016 - iopscience.iop.org
Recent progress in the description of glassy relaxation and aging are reviewed for the wide
class of network-forming materials such as GeO 2, Ge x Se 1− x, silicates (SiO 2–Na 2 O) or …
class of network-forming materials such as GeO 2, Ge x Se 1− x, silicates (SiO 2–Na 2 O) or …
Structure and properties of densified silica glass: characterizing the order within disorder
The broken symmetry in the atomic-scale ordering of glassy versus crystalline solids leads to
a daunting challenge to provide suitable metrics for describing the order within disorder …
a daunting challenge to provide suitable metrics for describing the order within disorder …
Development of Deep Potentials of Molten MgCl2–NaCl and MgCl2–KCl Salts Driven by Machine Learning
T Xu, X Li, Y Wang, Z Tang - ACS Applied Materials & Interfaces, 2023 - ACS Publications
Molten MgCl2-based chlorides have emerged as potential thermal storage and heat transfer
materials due to high thermal stabilities and lower costs. In this work, deep potential …
materials due to high thermal stabilities and lower costs. In this work, deep potential …
A holistic approach for elucidating local structure, dynamics, and speciation in molten salts with high structural disorder
To examine ion solvation, exchange, and speciation for minority components in molten salts
(MS) typically found as corrosion products, we propose a multimodal approach combining …
(MS) typically found as corrosion products, we propose a multimodal approach combining …
High-Pressure Transformation of Glass from a Tetrahedral to an Octahedral Network: A Joint Approach Using Neutron Diffraction and Molecular Dynamics
A Zeidler, K Wezka, RF Rowlands, DAJ Whittaker… - Physical review …, 2014 - APS
A combination of in situ high-pressure neutron diffraction at pressures up to 17.5 (5) GPa
and molecular dynamics simulations employing a many-body interatomic potential model is …
and molecular dynamics simulations employing a many-body interatomic potential model is …
Joint diffraction and modeling approach to the structure of liquid alumina
The structure of liquid alumina at a temperature∼ 2400 K near its melting point was
measured using neutron and high-energy x-ray diffraction by employing containerless …
measured using neutron and high-energy x-ray diffraction by employing containerless …
Understanding diffraction patterns of glassy, liquid and amorphous materials via persistent homology analyses
The absence of translational symmetry, and the very much present complexity in the
structure of glassy, liquid, and amorphous materials make glass science a challenging field …
structure of glassy, liquid, and amorphous materials make glass science a challenging field …
Unraveling Local Structure of Molten Salts via X-ray Scattering, Raman Spectroscopy, and Ab Initio Molecular Dynamics
In this work, we resolve a long-standing issue concerning the local structure of molten
MgCl2 by employing a multimodal approach, including X-ray scattering and Raman …
MgCl2 by employing a multimodal approach, including X-ray scattering and Raman …
Atomic and electronic structures of an extremely fragile liquid
The structure of high-temperature liquids is an important topic for understanding the fragility
of liquids. Here we report the structure of a high-temperature non-glass-forming oxide liquid …
of liquids. Here we report the structure of a high-temperature non-glass-forming oxide liquid …