scholarly journals Band splitting in bilayer stanene electronic structure scrutinized via first principle DFT calculations

2018 ◽  
Vol 17 ◽  
pp. e00341 ◽  
Author(s):  
Mohammed Ghadiyali ◽  
Sajeev Chacko
Keyword(s):  
Electronic Structure ◽  
Dft Calculations ◽  
First Principle ◽  
Band Splitting

DFT calculations of electronic structure evaluation and intermolecular interactions of p53-derived peptides with cytotoxic effect on breast cancer

2021 ◽  
Vol 140 (8) ◽  
Author(s):  
Carolina Barrientos-Salcedo ◽  
Maricarmen Lara-Rodríguez ◽  
Linda Campos-Fernández ◽  
Martha Legorreta-Herrera ◽  
Isabel Soto-Cruz ◽  
...  
Keyword(s):  
Breast Cancer ◽  
Electronic Structure ◽  
Dft Calculations ◽  
Intermolecular Interactions ◽  
Cytotoxic Effect ◽  
Structure Evaluation

First principle study on phase stability and electronic structure of YCu

2007 ◽  
Vol 368 (6) ◽  
pp. 495-498 ◽  
Author(s):  
Y.J. Shi ◽  
Y.L. Du ◽  
G. Chen ◽  
G.L. Chen
Keyword(s):  
Electronic Structure ◽  
Phase Stability ◽  
First Principle

Solvothermal synthesis of MnF2 nanocrystals and the first-principle study of its electronic structure

2009 ◽  
Vol 70 (3-4) ◽  
pp. 609-615 ◽  
Author(s):  
Xinxin Li ◽  
Jun Lu ◽  
Guochun Peng ◽  
Linpei Jin ◽  
Shuo Wei
Keyword(s):  
Electronic Structure ◽  
Solvothermal Synthesis ◽  
First Principle

Electronic Structure and Optical Properties of Antimony-Doped SnO 2 from First-Principle Study

2012 ◽  
Vol 57 (1) ◽  
pp. 145-150 ◽  
Author(s):  
Peng-Fei Lu ◽  
Yue Shen ◽  
Zhong-Yuan Yu ◽  
Long Zhao ◽  
Qiong-Yao Li ◽  
...  
Keyword(s):  
Optical Properties ◽  
Electronic Structure ◽  
First Principle
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