Ab initio study of structural, electronic and dielectric properties of free standing ultrathin nanowires of noble metals

2012 ◽  
Vol 46 ◽  
pp. 259-269 ◽  
Author(s):  
Arun Kumar ◽  
Ashok Kumar ◽  
P.K. Ahluwalia
Keyword(s):  
Dielectric Properties ◽  
Ab Initio ◽  
Noble Metals ◽  
Ab Initio Study ◽  
Free Standing

Optical and dielectric properties of lead perovskite and iodoplumbate complexes: an ab initio study

2020 ◽  
Vol 22 (33) ◽  
pp. 18423-18434
Author(s):  
Malladi Srikanth ◽  
Mailde S. Ozório ◽  
Juarez L. F. Da Silva
Keyword(s):  
Density Functional Theory ◽  
Dielectric Constant ◽  
Dielectric Properties ◽  
Ab Initio ◽  
Density Functional ◽  
Ab Initio Study ◽  
Functional Theory ◽  
Optical Dielectric Constant ◽  
Energetic Stability ◽  
Optical Dielectric

Optical and dielectric properties, and energetic stability orders of black phase of perovskites and yellow phase of iodoplumbates have been studied using density functional theory; where the optical dielectric constant varies with the polymorphic phase and nature of cation.

Ab initio study of the electronic, elastic, vibrational and dielectric properties of KBaBi

2019 ◽  
Vol 276 ◽  
pp. 272-277
Author(s):  
Zhen-Long Lv ◽  
Lei Zhao ◽  
Yong Wang ◽  
Hai-Yan Wang
Keyword(s):  
Dielectric Properties ◽  
Ab Initio ◽  
Ab Initio Study

scholarly journals Ab initio study of the trapping of polonium on noble metals

2016 ◽  
Vol 472 ◽  
pp. 35-42 ◽  
Author(s):  
Kim Rijpstra ◽  
Andy Van Yperen-De Deyne ◽  
Emilio Andrea Maugeri ◽  
Jörg Neuhausen ◽  
Michel Waroquier ◽  
...  
Keyword(s):  
Ab Initio ◽  
Noble Metals ◽  
Ab Initio Study

scholarly journals Ab-initio study of free standing TiO2 clusters: Stability and magnetism

2013 ◽  
Vol 113 (17) ◽  
pp. 17B526 ◽  
Author(s):  
T. H. Rana ◽  
Pankaj Kumar ◽  
A. K. Solanki ◽  
R. Skomski ◽  
A. Kashyap
Keyword(s):  
Ab Initio ◽  
Ab Initio Study ◽  
Free Standing

An ab initio study of Se-reacted GaAs(0 0 1) surfaces

1998 ◽  
Vol 184-185 (1-2) ◽  
pp. 80-84 ◽  
Author(s):  
W Faschinger
Keyword(s):  
Ab Initio ◽  
Ab Initio Study

Carrier Transport in 2-D Materials: an Ab Initio Study

2019 ◽  
Author(s):  
Mathieu Luisier ◽  
Aron Szabo ◽  
Cedric Klinkert ◽  
Christian Stieger ◽  
Martin Rau ◽  
...  
Keyword(s):  
Ab Initio ◽  
Carrier Transport ◽  
Ab Initio Study
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