Ab Initio Structure and Dynamics of CO2 at Supercritical Conditions

2019 ◽  
Vol 10 (24) ◽  
pp. 7554-7559 ◽  
Author(s):  
Wenhui Mi ◽  
Pablo Ramos ◽  
Jack Maranhao ◽  
Michele Pavanello
Keyword(s):  
Ab Initio ◽  
Supercritical Conditions ◽  
Structure And Dynamics ◽  
Ab Initio Structure

Ab initio structure determination of cytochrome c6 by combined reciprocal space-real space approach

2003 ◽  
Vol 218 (1) ◽  
Author(s):  
K. Chowdhury ◽  
S. Ghosh ◽  
M. Mukherjee
Keyword(s):  
Cytochrome C ◽  
Ab Initio ◽  
Structure Determination ◽  
Direct Method ◽  
Real Space ◽  
Reciprocal Space ◽  
Cytochrome C6 ◽  
Ab Initio Structure ◽  
Space Approach

AbstractThe direct method program SAYTAN has been applied successfully to redetermine the structure of cytochrome c

scholarly journals TEM 3-beam study of annealing effects in InGaNAs using ab-initio structure factors for strain-relaxed supercells

2011 ◽  
Vol 326 ◽  
pp. 012026 ◽  
Author(s):  
K Müller ◽  
M Schowalter ◽  
O Rubel ◽  
D Z Hu ◽  
D M Schaadt ◽  
...  
Keyword(s):  
Ab Initio ◽  
Structure Factors ◽  
Annealing Effects ◽  
Ab Initio Structure
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