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Calculating NMR chemical shifts using the augmented plane-wave method

✍ Scribed by Laskowski, Robert; Blaha, Peter


Book ID
121501033
Publisher
The American Physical Society
Year
2014
Tongue
English
Weight
221 KB
Volume
89
Category
Article
ISSN
1098-0121

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## Abstract Energy bands of VO are calculated by the augmented‐plane‐wave and Green's function methods. The results of calculations with different potentials are compared. The physical causes for differences in the bands are discussed.