scholarly journals Ab initio study of the structure and relative stability of MgSiO4H2 polymorphs at high pressures and temperatures

2021 ◽  
Keyword(s):  
Ab Initio ◽  
Relative Stability ◽  
High Pressures ◽  
Ab Initio Study ◽  
High Pressures And Temperatures

scholarly journals InBO3 and ScBO3 at high pressures: An ab initio study of elastic and thermodynamic properties

2016 ◽  
Vol 98 ◽  
pp. 198-208 ◽  
Author(s):  
O. Gomis ◽  
H.M. Ortiz ◽  
J.A. Sans ◽  
F.J. Manjón ◽  
D. Santamaría-Pérez ◽  
...  
Keyword(s):  
Thermodynamic Properties ◽  
Ab Initio ◽  
High Pressures ◽  
Ab Initio Study

Phase relations in the Fe-P system at high pressures and temperatures from ab initio computations

2020 ◽  
Vol 40 (2) ◽  
pp. 235-244 ◽  
Author(s):  
Nursultan E. Sagatov ◽  
Pavel N. Gavryushkin ◽  
Maksim V. Banayev ◽  
Talgat M. Inerbaev ◽  
Konstantin D. Litasov
Keyword(s):  
Ab Initio ◽  
High Pressures ◽  
Phase Relations ◽  
P System ◽  
High Pressures And Temperatures ◽  
Ab Initio Computations

scholarly journals Ab initio Determination of the Phase Diagram of CO2 at High Pressures and Temperatures

2020 ◽  
Vol 124 (9) ◽  
Author(s):  
Beatriz H. Cogollo-Olivo ◽  
Sananda Biswas ◽  
Sandro Scandolo ◽  
Javier A. Montoya
Keyword(s):  
Phase Diagram ◽  
Ab Initio ◽  
High Pressures ◽  
High Pressures And Temperatures

scholarly journals Ab initio study of the phase separation of argon in molten iron at high pressures

2006 ◽  
Vol 33 (6) ◽  
Author(s):  
S. Ostanin ◽  
D. Alfè ◽  
D. Dobson ◽  
L. Vočadlo ◽  
J. P. Brodholt ◽  
...  
Keyword(s):  
Phase Separation ◽  
Ab Initio ◽  
High Pressures ◽  
Molten Iron ◽  
Ab Initio Study
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