Structural changes in V2O5-P2O5 glasses: non-constant force field molecular dynamics and IR spectroscopy

Structural changes in V2O5-P2O5 glasses: non-constant force field molecular dynamics and IR spectroscopy

Quasi-binary phosphate-vanadate glasses have been studied by both IR spectroscopy and a novel method of molecular dynamics with a non-constant force field. This method is used for the self-assembly of structural models of glasses. The obtained models and the glass network structure are analyzed quan...

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Bibliographic Details
Main Authors: A. A. Raskovalov, N. S. Saetova, I. S. Popov
Format: Article
Language:English
Published: Uralʹskij federalʹnyj universitet imeni pervogo Prezidenta Rossii B.N. Elʹcina 2021-06-01
Series:Chimica Techno Acta
Subjects:
phosphate-vanadate glasses
ir spectroscopy
non-constant force field
molecular dynamics
self-assembly
Online Access:https://journals.urfu.ru/index.php/chimtech/article/view/5103

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