Stoichiometric tuning of lattice flexibility and Na diffusion in NaAlSiO4: quasielastic neutron scattering experiment and ab initio molecular dynamics simulations

Author:

Gupta Mayanak K.12345ORCID,Mittal Ranjan12346ORCID,Kumar Sajan12346,Singh Baltej12346,Jalarvo Niina H.78910ORCID,Delaire Olivier51110ORCID,Shukla Rakesh12234,Achary Srungarpu N.6134122ORCID,Kolesnikov Alexander I.78910,Tyagi Avesh K.6134122ORCID,Chaplot Samrath L.12346ORCID

Affiliation:

1. Solid State Physics Division

2. Bhabha Atomic Research Centre

3. Mumbai 400085

4. India

5. Department of Mechanical Engineering and Materials Science

6. Homi Bhabha National Institute

7. Neutron Scattering Division

8. Oak Ridge National Laboratory

9. Oak Ridge

10. USA

11. Duke University

12. Chemistry Division

13. Mumbai 400094

Abstract

Na diffusion enabled by stoichiometric tuning of lattice flexibility.

Funder

Indian National Science Academy

Publisher

Royal Society of Chemistry (RSC)

Subject

General Materials Science,Renewable Energy, Sustainability and the Environment,General Chemistry

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