scholarly journals First-principles study of the effect of lattice vibrations on Cu nucleation free energy in Fe-Cu alloys

2005 ◽  
Vol 72 (17) ◽  
Author(s):  
Koretaka Yuge ◽  
Atsuto Seko ◽  
Isao Tanaka ◽  
Shigeto R. Nishitani
Keyword(s):  
Free Energy ◽  
First Principles ◽  
Lattice Vibrations ◽  
First Principles Study ◽  
Cu Alloys

scholarly journals First-principles study of coadsorption of Cu2+ and Cl− ions on the Cu (110) surface

RSC Advances ◽  
2020 ◽  
Vol 10 (14) ◽  
pp. 8212-8217
Author(s):  
Khoong Hong Khoo ◽  
Bharathi Madurai Srinivasan ◽  
Ramanarayan Hariharaputran ◽  
Chaitanya Amol Joshi ◽  
David Wu Tai-Yen ◽  
...  
Keyword(s):  
Free Energy ◽  
Dft Calculations ◽  
First Principles ◽  
Electrode Potential ◽  
Free Energy Of Adsorption ◽  
First Principles Study

Free energy of adsorption for the most stable phases predicted by DFT calculations as a function of electrode potential.

First-principles study of the formation of Guinier–Preston zones in Al–Cu alloys

2004 ◽  
Vol 51 (7) ◽  
pp. 665-669 ◽  
Author(s):  
S.Q. Wang ◽  
M. Schneider ◽  
H.Q. Ye ◽  
G. Gottstein
Keyword(s):  
First Principles ◽  
First Principles Study ◽  
Cu Alloys

First-principles study on the elastic properties of B′ and Q phase in Al–Mg–Si (–Cu) alloys

2012 ◽  
Vol 87 (1) ◽  
pp. 015601 ◽  
Author(s):  
Rong-Kai Pan ◽  
Li Ma ◽  
Nan Bian ◽  
Ming-Hui Wang ◽  
Peng-Bo Li ◽  
...  
Keyword(s):  
Elastic Properties ◽  
First Principles ◽  
First Principles Study ◽  
Cu Alloys
Sign in / Sign up

Export Citation Format

Share Document