scholarly journals Electronic structure of interstitial hydrogen in lutetium oxide fromDFT+Ucalculations and comparison study withμSRspectroscopy

2016 ◽  
Vol 94 (1) ◽  
Author(s):  
E. Lora da Silva ◽  
A. G. Marinopoulos ◽  
R. B. L. Vieira ◽  
R. C. Vilão ◽  
H. V. Alberto ◽  
...  
Keyword(s):  
Electronic Structure ◽  
Comparison Study ◽  
Lutetium Oxide ◽  
Interstitial Hydrogen

scholarly journals Electronic structure of the ingredient planes of the cuprate superconductorBi2Sr2CuO6+δ: A comparison study withBi2Sr2CaCu2O8+δ

2016 ◽  
Vol 93 (14) ◽  
Author(s):  
Yan-Feng Lv ◽  
Wen-Lin Wang ◽  
Hao Ding ◽  
Yang Wang ◽  
Ying Ding ◽  
...  
Keyword(s):  
Electronic Structure ◽  
Comparison Study

Comparison study of the electronic structure of high-TC superconductors

1995 ◽  
Vol 56 (S29) ◽  
pp. 189-195 ◽  
Author(s):  
Qinghua Jin ◽  
Changjiang Mei ◽  
Vedene H. Smith
Keyword(s):  
Electronic Structure ◽  
Comparison Study ◽  
High Tc Superconductors ◽  
High Tc

The effect of interstitial hydrogen on the electronic structure of Fe–Pd alloys

2004 ◽  
Vol 65 (11) ◽  
pp. 1799-1807 ◽  
Author(s):  
Estela A. Gonzalez ◽  
Paula V. Jasen ◽  
Norberto J. Castellani ◽  
Alfredo Juan
Keyword(s):  
Electronic Structure ◽  
Interstitial Hydrogen

Theoretical investigation on the interaction between RhIII octaethylporphyrin and a graphite basal surface: a comparison study of DFT, DFT-D, and AFM

2018 ◽  
Vol 20 (30) ◽  
pp. 20235-20246 ◽  
Author(s):  
Kohei Tada ◽  
Yasushi Maeda ◽  
Hiroyuki Ozaki ◽  
Shingo Tanaka ◽  
Shin-ichi Yamazaki
Keyword(s):  
Density Functional Theory ◽  
Atomic Force Microscopy ◽  
Electronic Structure ◽  
Theoretical Investigation ◽  
Density Functional ◽  
Comparison Study ◽  
Basal Surface ◽  
Functional Theory ◽  
Force Microscopy ◽  
Atomic Force

Using density functional theory based calculations and atomic-force-microscopy observations, we investigated the interaction between [RhIII(OEP)(Cl)] (OEP = octaethylporphyrin) and a graphite basal surface, and the electronic structure of [RhIII(OEP)(Cl)]/graphite.

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