Three-body-interaction effects on the phase-transition and high-pressure behavior of divalent-metal oxides

1987 ◽  
Vol 35 (10) ◽  
pp. 5235-5243 ◽  
Author(s):  
K. N. Jog ◽  
Sankar P. Sanyal ◽  
R. K. Singh
1985 ◽  
Vol 31 (9) ◽  
pp. 6047-6057 ◽  
Author(s):  
K. N. Jog ◽  
R. K. Singh ◽  
S. P. Sanyal

2005 ◽  
Vol 32 (10) ◽  
pp. 721-725 ◽  
Author(s):  
Shigehiko Tateno ◽  
Kei Hirose ◽  
Nagayoshi Sata ◽  
Yasuo Ohishi

2018 ◽  
Vol 45 (10) ◽  
pp. 945-962
Author(s):  
Paolo Lotti ◽  
Davide Comboni ◽  
Marco Merlini ◽  
Michael Hanfland

Open Physics ◽  
2008 ◽  
Vol 6 (2) ◽  
Author(s):  
Purvee Bhardwaj ◽  
Sadhna Singh ◽  
Neeraj Gaur

AbstractIn the present paper we have investigated the high-pressure, structural phase transition of Barium chalcogenides (BaO, BaSe and BaTe) using a three-body interaction potential (MTBIP) approach, modified by incorporating covalency effects. Phase transition pressures are associated with a sudden collapse in volume. The phase transition pressures and associated volume collapses obtained from TBIP show a reasonably good agreement with experimental data. Here, the transition pressure, NaCl-CsCl structure increases with decreasing cation-to-anion radii ratio. In addition, the elastic constants and their combinations with pressure are also reported. It is found that TBP incorporating a covalency effect may predict the phase transition pressure, the elastic constants and the pressure derivatives of other chalcogenides as well.


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