PARTICLE OCTUPOLE EXCHANGE COUPLING IN THE YRAST LINES OF TERBIUM AND DYSPROSIUM NUCLEI

1980 ◽  
Vol 41 (C10) ◽  
pp. C10-43-C10-46
Author(s):  
P. Kleinheinz
Keyword(s):  
2019 ◽  
Author(s):  
Xianghai Sheng ◽  
Lee Thompson ◽  
Hrant Hratchian

This work evaluates the quality of exchange coupling constant and spin crossover gap calculations using density functional theory corrected by the Approximate Projection model. Results show that improvements using the Approximate Projection model range from modest to significant. This study demonstrates that, at least for the class of systems examined here, spin-projection generally improves the quality of density functional theory calculations of J-coupling constants and spin crossover gaps. Furthermore, it is shown that spin-projection can be important for both geometry optimization and energy evaluations. The Approximate Project model provides an affordable and practical approach for effectively correcting spin-contamination errors in molecular exchange coupling constant and spin crossover gap calculations.


2009 ◽  
Vol 321 (9) ◽  
pp. 1214-1220 ◽  
Author(s):  
M. Marcellini ◽  
M. Pärnaste ◽  
B. Hjörvarsson ◽  
G. Nowak ◽  
H. Zabel

2002 ◽  
Vol 124 (18) ◽  
pp. 5197-5205 ◽  
Author(s):  
Cédric Desplanches ◽  
Eliseo Ruiz ◽  
Antonio Rodríguez-Fortea ◽  
Santiago Alvarez

2021 ◽  
Vol 45 (5) ◽  
pp. 2742-2753
Author(s):  
Nishithendu Bikash Nandi ◽  
Atanu Purkayastha ◽  
Shaktibrata Roy ◽  
Julia Kłak ◽  
Rakesh Ganguly ◽  
...  

A new doubly opened 4 + 2 Cu4O4 cubane cluster exhibits strong antiferromagnetic exchange coupling with J1 = −110.1 cm−1, and J2 = −27.1 cm−1.


Author(s):  
Chuyang Liu ◽  
Tao Jiang ◽  
Tian Gao ◽  
Guangxian Xia ◽  
Yufan Cao ◽  
...  

It is well known that both hard/soft magnetic exchange-coupling and ferroelectric-ferromagnetic coupling could facilitate the microwave absorption behavior. Herein, we propose the BaZrxFe12-xO19/Fe3O4/BaZrO3 composites to integrate the advantages of the...


1996 ◽  
Vol 76 (20) ◽  
pp. 3834-3837 ◽  
Author(s):  
J. Kudrnovský ◽  
V. Drchal ◽  
C. Blaas ◽  
I. Turek ◽  
P. Weinberger

2021 ◽  
Vol 6 (1) ◽  
Author(s):  
Thiago R. F. Peixoto ◽  
Hendrik Bentmann ◽  
Philipp Rüßmann ◽  
Abdul-Vakhab Tcakaev ◽  
Martin Winnerlein ◽  
...  

A Correction to this paper has been published: https://doi.org/10.1038/s41535-021-00314-9


2021 ◽  
Vol 11 (2) ◽  
Author(s):  
Haifeng Qiao ◽  
Yadav P. Kandel ◽  
Kuangyin Deng ◽  
Saeed Fallahi ◽  
Geoffrey C. Gardner ◽  
...  

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