Effect of disorder produced by cationic vacancies at theBsites on the electronic properties of mixed valence manganites

1999 ◽  
Vol 60 (2) ◽  
pp. 1127-1135 ◽  
Author(s):  
J. Vergara ◽  
R. J. Ortega-Hertogs ◽  
V. Madurga ◽  
F. Sapiña ◽  
Z. El-Fadli ◽  
...  
1995 ◽  
Vol 75 (21) ◽  
pp. 3910-3913 ◽  
Author(s):  
J. M. D. Coey ◽  
M. Viret ◽  
L. Ranno ◽  
K. Ounadjela

2018 ◽  
Vol 10 (21) ◽  
pp. 18029-18035 ◽  
Author(s):  
Shanquan Chen ◽  
Changxin Guan ◽  
Shanming Ke ◽  
Xierong Zeng ◽  
Chuanwei Huang ◽  
...  

2008 ◽  
Vol 1074 ◽  
Author(s):  
Yun Hee Jang ◽  
François Gervais ◽  
Yves Lansac

ABSTRACTThe possibility of an A-site (La3+/Sr2+) ordering in a colossal magnetoresistance manganite (CMR) La3/4Sr1/4MnO3 was explored using molecular dynamics (MD) simulations with a newly developed force field (FF) and quantum mechanics (QM) calculations on the structures obtained from MD. The calculated degrees of stabilization (enthalpy gain) of various patterns of A-site ordering are not significant enough to overcome the accompanying entropy loss, supporting the random A-site distribution in La3/4Sr1/4MnO3. This approach combining MD and QM as well as the versatile FF developed in this study should be useful to investigate the structures and functions of magnetic tunnel junction devices involving mixed-valence manganites.


1989 ◽  
Vol 156 ◽  
Author(s):  
M. Pouchard ◽  
J-C. Grenier ◽  
J-P. Doumerc ◽  
G. Demazeau ◽  
J-P. Chaminade ◽  
...  

ABSTRACTIn the scope of the Goodenough model, a brief review of the electronic properties of some 3d transition elements (M = Fe, Co, Ni and Cu ) is given; the main relevant electronic and structural parameters are emphasized. Then a special attention is focussed on N/(N−1) and N/(N−2) electron mixed valence compounds.Finally some particular features of copper are discussed and their relevance to high Tc superconductors is pointed out:-the srong covalency of Cu-O bondings involving a possible delocalization of the hole between trivalent copper and oxygen,-the existence of low and high spin electronic configurations for CuIII,-the disproportionation of Cu2+ and its role in the formation of hole pairs,Cu-O distances very close for the three successive oxidation states of copper favouring the disproportionation process.


1997 ◽  
Vol 55 (2) ◽  
pp. R668-R671 ◽  
Author(s):  
J. L. García-Muñoz ◽  
J. Fontcuberta ◽  
B. Martínez ◽  
A. Seffar ◽  
S. Piñol ◽  
...  

2018 ◽  
Vol 11 (77) ◽  
pp. 3827-3839 ◽  
Author(s):  
H. H. Ortiz-Alvarez ◽  
E. Restrepo-Parra ◽  
F. N. Jimenez-Garcia

1990 ◽  
Vol 121 (1-3) ◽  
pp. 35-39 ◽  
Author(s):  
J. Livage ◽  
J.P. Jolivet ◽  
E. Tronc

ChemInform ◽  
2010 ◽  
Vol 41 (43) ◽  
pp. no-no
Author(s):  
J. M. D. Coey ◽  
M. Viret ◽  
S. von Molnar

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