scholarly journals First-principles study and experimental characterization of metal incorporation in germanium telluride

2020 ◽  
Vol 128 (22) ◽  
pp. 225306
Author(s):  
Kayla A. Cooley ◽  
Nathan Keilbart ◽  
James G. Champlain ◽  
Laura B. Ruppalt ◽  
Timothy N. Walter ◽  
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Keyword(s):  
First Principles ◽  
Experimental Characterization ◽  
Germanium Telluride ◽  
First Principles Study ◽  
Metal Incorporation

Characterization of stearic acid adsorption on Ni(111) surface by experimental and first-principles study approach

2011 ◽  
Vol 109 (7) ◽  
pp. 07C115 ◽  
Author(s):  
S. H. Liang ◽  
T. Yu ◽  
D. P. Liu ◽  
W. X. Wang ◽  
Y. P. Wang ◽  
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Keyword(s):  
Stearic Acid ◽  
First Principles ◽  
Study Approach ◽  
First Principles Study

Partially-oxidized phosphorene sensor for the detection of sub-nano molar concentrations of nitric oxide: a first-principles study

2019 ◽  
Vol 21 (35) ◽  
pp. 19083-19091 ◽  
Author(s):  
Juan M. Marmolejo-Tejada ◽  
Andres Jaramillo-Botero
Keyword(s):  
Nitric Oxide ◽  
First Principles ◽  
First Principles Study

First-principles design and characterization of a partially oxidized phosphorene device for nM L−1 detection and measurement of nitric oxide.

First-principles and experimental characterization of the electronic properties of CaGaSiN3 and CaAlSiN3: the impact of chemical disorder

2017 ◽  
Vol 19 (13) ◽  
pp. 9292-9299 ◽  
Author(s):  
Robin Niklaus ◽  
Ján Minár ◽  
Jonas Häusler ◽  
Wolfgang Schnick
Keyword(s):  
Electronic Properties ◽  
First Principles ◽  
Theoretical Basis ◽  
Experimental Characterization ◽  
Host Materials ◽  
Chemical Disorder ◽  
The Impact

Understanding the impact of chemical disorder on the electronic properties of LED phosphor host materials on a theoretical basis.

NMR characterization of hydrocarbon adsorption on calcite surfaces: A first principles study

2014 ◽  
Vol 141 (20) ◽  
pp. 204705 ◽  
Author(s):  
Rochele C. A. Bevilaqua ◽  
Vagner A. Rigo ◽  
Marcos Veríssimo-Alves ◽  
Caetano R. Miranda
Keyword(s):  
First Principles ◽  
Hydrocarbon Adsorption ◽  
First Principles Study ◽  
Nmr Characterization

First-principles and experimental characterization of the electronic and optical properties of CaS and CaO

2013 ◽  
Vol 35 (7) ◽  
pp. 1477-1480 ◽  
Author(s):  
S. Poncé ◽  
B. Bertrand ◽  
P.F. Smet ◽  
D. Poelman ◽  
M. Mikami ◽  
...  
Keyword(s):  
Optical Properties ◽  
First Principles ◽  
Experimental Characterization ◽  
Electronic And Optical Properties

scholarly journals First-Principles Study, Fabrication and Characterization of (Zr0.25Nb0.25Ti0.25V0.25)C High-Entropy Ceramic

2018 ◽  
Author(s):  
Beilin Ye ◽  
Tongqi Wen ◽  
Manh Cuong Nguyen ◽  
Luyao Hao ◽  
Cai-Zhuang Wang ◽  
...  
Keyword(s):  
First Principles ◽  
High Entropy ◽  
First Principles Study ◽  
Fabrication And Characterization

scholarly journals First-principles study, fabrication and characterization of (Zr0.25Nb0.25Ti0.25V0.25)C high-entropy ceramics

2019 ◽  
Vol 170 ◽  
pp. 15-23 ◽  
Author(s):  
Beilin Ye ◽  
Tongqi Wen ◽  
Manh Cuong Nguyen ◽  
Luyao Hao ◽  
Cai-Zhuang Wang ◽  
...  
Keyword(s):  
First Principles ◽  
High Entropy ◽  
First Principles Study ◽  
Fabrication And Characterization
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