scholarly journals First-principles study of the pressure dependence of the structural and vibrational properties of the ternary metal hydrideCa2RuH6

2007 ◽  
Vol 76 (1) ◽  
Author(s):  
Latévi Max Lawson Daku ◽  
Hans Hagemann
Keyword(s):  
Pressure Dependence ◽  
First Principles ◽  
Vibrational Properties ◽  
First Principles Study ◽  
Ternary Metal

First principles study of structural, electronic and vibrational properties of heavily boron-doped diamond

2009 ◽  
Vol 373 (29) ◽  
pp. 2494-2500 ◽  
Author(s):  
Li Niu ◽  
Jia-Qi Zhu ◽  
Xiao Han ◽  
Man-Lin Tan ◽  
Wei Gao ◽  
...  
Keyword(s):  
First Principles ◽  
Vibrational Properties ◽  
Boron Doped Diamond ◽  
First Principles Study ◽  
Boron Doped

First-principles study of pressure dependence superconductivity in technetium and tantalum

2021 ◽  
Vol 340 ◽  
pp. 114526
Author(s):  
Amit K. Shah ◽  
Ramila Khatiwada ◽  
Narayan P. Adhikari ◽  
Rajendra P. Adhikari
Keyword(s):  
Pressure Dependence ◽  
First Principles ◽  
First Principles Study

First principles study of surface stability and segregation of PdRuRh ternary metal alloy system

2018 ◽  
Vol 671 ◽  
pp. 51-59 ◽  
Author(s):  
Susan Meñez Aspera ◽  
Ryan Lacdao Arevalo ◽  
Hiroshi Nakanishi ◽  
Hideaki Kasai
Keyword(s):  
First Principles ◽  
Alloy System ◽  
Metal Alloy ◽  
Surface Stability ◽  
First Principles Study ◽  
Ternary Metal

First-principles study of structural, electronic and vibrational properties of aluminum-doped silica nanotubes

2010 ◽  
Vol 498 (1-3) ◽  
pp. 172-177 ◽  
Author(s):  
Shengli Zhang ◽  
Yonghong Zhang ◽  
Shiping Huang ◽  
Hui Liu ◽  
Huiping Tian
Keyword(s):  
First Principles ◽  
Vibrational Properties ◽  
Silica Nanotubes ◽  
First Principles Study
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