Lattice dynamics and the phase diagram of sodium at high pressures and temperatures from ab initio calculations

2011 ◽  
Vol 56 (4) ◽  
pp. 676-679 ◽  
Author(s):  
E. G. Maksimov ◽  
S. V. Lepeshkin ◽  
M. V. Magnitskaya
Keyword(s):  
Phase Diagram ◽  
Ab Initio Calculations ◽  
Ab Initio ◽  
Lattice Dynamics ◽  
High Pressures ◽  
High Pressures And Temperatures

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

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

Lattice dynamics of Ga1−xAlxAs studied by ab initio calculations

1999 ◽  
Vol 13 (4) ◽  
pp. 232-238 ◽  
Author(s):  
M. Sternik ◽  
P.T. Jochym ◽  
K. Parlinski
Keyword(s):  
Ab Initio Calculations ◽  
Ab Initio ◽  
Lattice Dynamics

Phase stability of Li–Mn–O oxides as cathode materials for Li-ion batteries: insights from ab initio calculations

2014 ◽  
Vol 16 (23) ◽  
pp. 11233-11242 ◽  
Author(s):  
R. C. Longo ◽  
F. T. Kong ◽  
Santosh KC ◽  
M. S. Park ◽  
J. Yoon ◽  
...  
Keyword(s):  
Phase Diagram ◽  
Ab Initio Calculations ◽  
Ab Initio ◽  
Phase Stability ◽  
Cathode Materials ◽  
Chemical Potential ◽  
Li Ion Batteries ◽  
Li Ion ◽  
O Phase

The Li–Mn–O phase diagram as a function of the chemical potential of Li and O and the pH.

Sign in / Sign up

Export Citation Format

Share Document