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2018 ◽  
Vol 39 (19) ◽  
pp. 1300-1306 ◽  
Author(s):  
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Dariusz Maciej Pisklak ◽  
Monika Zielińska-Pisklak
Keyword(s):  
Phase Transitions ◽  
First Principles ◽  
Molecular Crystals ◽  
Structure And Stability ◽  
First Principles Study ◽  
Increased Pressure

First principles study on surface structure and stability of alloyed cementite doped with Cr

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Vol 100 ◽  
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Author(s):  
Yang Gao ◽  
Zhiqing Lv ◽  
Shuhua Sun ◽  
Minggui Qu ◽  
Zhongping Shi ◽  
...  
Keyword(s):  
Surface Structure ◽  
First Principles ◽  
Structure And Stability ◽  
First Principles Study ◽  
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Temperature-induced phase transitions in the rock-salt type SiC: a first-principles study

2019 ◽  
Vol 31 (40) ◽  
pp. 405401 ◽  
Author(s):  
V I Ivashchenko ◽  
P E A Turchi ◽  
Leonid Gorb ◽  
Jerzy Leszczynski ◽  
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Keyword(s):  
Phase Transitions ◽  
Rock Salt ◽  
First Principles ◽  
First Principles Study
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