Ab initio calculations of energetic and structural properties of the single-atom peri-bridged naphthalene compounds

2001 ◽  
Vol 540 (1-3) ◽  
pp. 287-294 ◽  
Author(s):  
H Roohi ◽  
F Deyhimi ◽  
A Ebrahimi
Keyword(s):  
Ab Initio Calculations ◽  
Ab Initio ◽  
Structural Properties ◽  
Single Atom

Hydrogen induced changes in structural properties of iron: Ab initio calculations

2011 ◽  
pp. 79-84 ◽  
Author(s):  
Alejandro Castedo ◽  
Javier Sanchez ◽  
José Fullea ◽  
Carmen Andrade ◽  
Pedro Luis Andres
Keyword(s):  
Ab Initio Calculations ◽  
Ab Initio ◽  
Structural Properties ◽  
Induced Changes
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