Density Functional Theory-Assisted 31P and 23Na Magic-Angle Spinning Nuclear Magnetic Resonance Study of the Na3V2(PO4)2F3–Na3V2(PO4)2FO2 Solid Solution: Unraveling Its Local and Electronic Structures
Author(s) -
Long H. B. Nguyen,
Paula Sanz Camacho,
Thibault Broux,
Jacob Olchowka,
Christian Masquelier,
Laurence Croguennec,
Dany Carlier
Publication year - 2019
Publication title -
chemistry of materials
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 3.741
H-Index - 375
eISSN - 1520-5002
pISSN - 0897-4756
DOI - 10.1021/acs.chemmater.9b03546
Subject(s) - fermi contact interaction , magic angle spinning , ion , atomic orbital , density functional theory , electron paramagnetic resonance , fermi level , crystallography , chemistry , resonance (particle physics) , electronic structure , nuclear magnetic resonance spectroscopy , atomic physics , molecular physics , materials science , nuclear magnetic resonance , electron , hyperfine structure , computational chemistry , physics , stereochemistry , organic chemistry , quantum mechanics
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