Effect of a magnetic order on the phase stability of the parent chalcogenide compound FeSe

JETP Letters ◽  
2016 ◽  
Vol 103 (4) ◽  
pp. 265-271 ◽  
Author(s):  
S. L. Skornyakov ◽  
I. Leonov ◽  
V. I. Anisimov
1998 ◽  
Vol 57 (14) ◽  
pp. 8509-8517 ◽  
Author(s):  
A. Tkachuk ◽  
K. Rogacki ◽  
D. E. Brown ◽  
B. Dabrowski ◽  
A. J. Fedro ◽  
...  

2022 ◽  
Vol 1213 (1) ◽  
pp. 012008
Author(s):  
K R Erager ◽  
V V Sokolovskiy ◽  
V D Buchelnikov

Abstract Using ab initio calculations, the phase stability of modulated and tetragonal martensitic structures in Ni43.75Co6.25Mn43.75(In, Sn)6.25 Heusler alloys with different magnetic order is investigated. The stability against the segregation is considered by a method for generating all possible decay reactions assuming the calculated ground state energies of each composition. It is shown that the highest probable stability under equilibrium conditions is demonstrated by alloys with tetragonal martensitic structure in accordance with reactions: Ni35Co5Mn35In5 → 25Mn + 35Ni + 5Mn2InCo and Ni35Co5Mn35Sn5 → 5CoSn + 35Mn + 35Ni.


2020 ◽  
Vol 8 (44) ◽  
pp. 15852-15859
Author(s):  
Jiu Chen ◽  
Fuhua Li ◽  
Yurong Tang ◽  
Qing Tang

Chemical functionalization can significantly improve the stability of meta-stable 1T′-MoS2 and tune the surface HER activity.


1988 ◽  
Vol 49 (C8) ◽  
pp. C8-733-C8-734 ◽  
Author(s):  
I. Felner ◽  
I. Nowik ◽  
Y. Yeshurun

1988 ◽  
Vol 49 (C8) ◽  
pp. C8-363-C8-364 ◽  
Author(s):  
R. Caudron ◽  
H. Bouchiat ◽  
P. J. Brown ◽  
P. Monod ◽  
J. L. Tholence
Keyword(s):  

1998 ◽  
Vol 538 ◽  
Author(s):  
Raúl A. Enrique ◽  
Pascal Bellon

AbstractPhase stability in alloys under irradiation is studied considering effective thermodynamic potentials. A simple kinetic model of a binary alloy with phase separation is investigated. Time evolution in the alloy results from two competing dynamics: thermal diffusion, and irradiation induced ballistic exchanges. The dynamical (steady state) phase diagram is evaluated exactly performing Kinetic Monte Carlo simulations. The solution is then compared to two theoretical frameworks: the effective quasi-interactions model as proposed by Vaks and Kamishenko, and the effective free energy model as proposed by Martin. New developments of these models are proposed to allow for quantitative comparisons. Both theoretical frameworks yield fairly good approximations to the dynamical phase diagram.


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