Unexpected origin of magnetism in monoclinic Nb12O29 from first-principles calculations-Reference-Cited by-同舟云学术

Unexpected origin of magnetism in monoclinic Nb12O29 from first-principles calculations

Published:2015 Issue:3 Volume:3 Page:651-657
ISSN:2050-7526
Container-title:Journal of Materials Chemistry C
language:en
Short-container-title:J. Mater. Chem. C

Author:

Fang C. M.¹²³⁴⁵,van Huis M. A.¹²³⁴⁵,Xu Q.¹²³⁴,Cava R. J.⁶⁷⁸⁹,Zandbergen H. W.¹²³⁴

Affiliation:

1. Kavli Institute of Nanoscience

2. Delft University of Technology

3. NL-2628 CJ Delft

4. The Netherlands

5. Debye Institute for Nanomaterials Science

6. Department of Chemistry

7. Princeton University

8. Princeton

9. USA

Abstract

The unusual magnetism of m-Nb₁₂O₂₉ is attributed to the Nb atoms with valence states close to Nb⁵⁺(d⁰). This is in clear contradiction to the general belief that the magnetism originates from the Nb⁴⁺(d¹) atoms.

Publisher

Royal Society of Chemistry (RSC)

Subject

Materials Chemistry,General Chemistry

Link

http://pubs.rsc.org/en/content/articlepdf/2015/TC/C4TC02222J

Reference32 articles.

1. The Crystal Structure of Nb12O29(o-rh).

2. The Crystal Structure of Nb12O29(mon).

3. Structures of the reduced niobium oxides Nb12O29 and Nb22O54

4. Antiferromagnetism and metallic conductivity in Nb12O29

5. Electrical and magnetic properties ofNb2O5−δcrystallographic shear structures

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