scholarly journals SrTiO3(001)(2×1)reconstructions: First-principles calculations of surface energy and atomic structure compared with scanning tunneling microscopy images

2004 ◽  
Vol 70 (8) ◽  
Author(s):  
Karen Johnston ◽  
Martin R. Castell ◽  
Anthony T. Paxton ◽  
Michael W. Finnis
2018 ◽  
Vol 20 (22) ◽  
pp. 15350-15357 ◽  
Author(s):  
M.-A. Dubois ◽  
O. Guillermet ◽  
S. Gauthier ◽  
G. Zhan ◽  
Y. Makoudi ◽  
...  

The formation of highly organized structures based on two ligands with pyridyl functionalities, 4,4′-bipyridine (BPY) and 1,4-di(4,4′′-pyridyl) benzene (BPYB), and Cu adatoms on the Cu(111) surface has been studied with low temperature and variable temperature scanning tunneling microscopy (STM) and first-principles calculations.


1987 ◽  
Vol 35 (14) ◽  
pp. 7790-7793 ◽  
Author(s):  
David Tománek ◽  
Steven G. Louie ◽  
H. Jonathon Mamin ◽  
David W. Abraham ◽  
Ruth Ellen Thomson ◽  
...  

2015 ◽  
Vol 17 (14) ◽  
pp. 8776-8783 ◽  
Author(s):  
H. Aldahhak ◽  
S. Matencio ◽  
E. Barrena ◽  
C. Ocal ◽  
W. G. Schmidt ◽  
...  

First-principles calculations were combined with scanning tunneling microscopy (STM) measurements to analyze the adsorption of diindenoperylene (DIP) molecules on Cu(111) surfaces.


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