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 …
understanding the properties of amorphous materials with high-performance computing methods
JK Christie - … Transactions of the Royal Society A, 2023 - royalsocietypublishing.org
Amorphous materials have no long-range order in their atomic structure. This makes much
of the formalism for the study of crystalline materials irrelevant, and so elucidating their …
of the formalism for the study of crystalline materials irrelevant, and so elucidating their …
[图书][B] Glassy materials and disordered solids: An introduction to their statistical mechanics
K Binder, W Kob - 2011 - books.google.com
This book gives a pedagogical introduction to the physics of amorphous solids and related
disordered condensed matter systems. Important concepts from statistical mechanics such …
disordered condensed matter systems. Important concepts from statistical mechanics such …
The structure of GeO2–SiO2 glasses and melts: A Raman spectroscopy study
GS Henderson, DR Neuville, B Cochain… - Journal of Non …, 2009 - Elsevier
We have investigated a series of glasses and melts along the GeO2–SiO2 join using insitu
Raman spectroscopy. The results for both the glasses and melts are consistent with a …
Raman spectroscopy. The results for both the glasses and melts are consistent with a …
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 …
Ring size distribution in silicate glasses revealed by neutron scattering first sharp diffraction peak analysis
Silicate glasses have no long range order and a short range order similar to their crystalline
counter-parts. Therefore, their key structurally distinct information lies in the medium range …
counter-parts. Therefore, their key structurally distinct information lies in the medium range …
Networks under pressure: the development of in situ high-pressure neutron diffraction for glassy and liquid materials
The pressure-driven collapse in the structure of network-forming materials will be
considered in the gigapascal (GPa) regime, where the development of in situ high-pressure …
considered in the gigapascal (GPa) regime, where the development of in situ high-pressure …
Computational simulations of solid state NMR spectra: a new era in structure determination of oxide glasses
The application of the MD–GIPAW approach to the calculation of NMR parameters, line
widths and shapes of the spectra of oxide glasses is reviewed. Emphasis is given to the …
widths and shapes of the spectra of oxide glasses is reviewed. Emphasis is given to the …
Amorphous Zirconia-doped Tantala modeling and simulations using explicit multi-element spectral neighbor analysis machine learning potentials (EME-SNAP)
We model amorphous Zirconia-doped Tantala with machine learning interactomc potentials
based on explicit multielement spectral neighbor analysis (EME-SNAP). These atomic …
based on explicit multielement spectral neighbor analysis (EME-SNAP). These atomic …
Angular rigidity in tetrahedral network glasses with changing composition
A set of oxide and chalcogenide tetrahedral glasses is investigated using molecular
dynamics simulations. We show that the changes in the Ge composition affect mostly …
dynamics simulations. We show that the changes in the Ge composition affect mostly …