Alternative insight into aluminium-phosphate glass network from ab initio molecular dynamics simulations
L. Stoch, Paweł Goj, Aleksandra Wajda, Agata Stoch
Topics & Concepts
Materials scienceCovalent bondBond orderAb initioAluminiumPhosphate glassElectron localization functionMolecular dynamicsAluminium phosphateTetrahedronChemical physicsBond lengthCrystallographyComputational chemistryCrystal structureElectronChemistryComposite materialOrganic chemistryPhysicsQuantum mechanicsOptoelectronicsDopingGlass properties and applicationsLuminescence Properties of Advanced MaterialsPhase-change materials and chalcogenides