Optical properties of C28 fullerene cage: A DFT study

2018 ◽  
Author(s):  
Debolina Paul ◽  
Barnali Bhattacharya ◽  
Jyotirmoy Deb ◽  
Utpal Sarkar
Keyword(s):  
Optical Properties ◽  
Dft Study ◽  
Fullerene Cage

scholarly journals DFT study of superhalogen and superalkali doped graphitic carbon nitride and its non-linear optical properties

RSC Advances ◽  
2021 ◽  
Vol 11 (14) ◽  
pp. 7779-7789 ◽  
Author(s):  
Asmat Ullah Khan ◽  
Rasheed Ahmad Khera ◽  
Naveed Anjum ◽  
Rao Aqil Shehzad ◽  
Saleem Iqbal ◽  
...  
Keyword(s):  
Optical Properties ◽  
Dft Calculations ◽  
Nonlinear Optical ◽  
Carbon Nitride ◽  
Graphitic Carbon ◽  
Graphitic Carbon Nitride ◽  
Dft Study ◽  
Nlo Properties ◽  
Non Linear ◽  
Linear Optical Properties

DFT calculations are carried out to investigate nonlinear optical (NLO) properties of superhalogen (BCl4) and superalkali (NLi4) doped graphitic carbon nitride (GCN).

Electronic and electro-optical properties of 5CB and 5CT liquid crystal molecules: A comparative DFT study

Pramana ◽  
2021 ◽  
Vol 95 (2) ◽  
Author(s):  
Dipendra Sharma ◽  
Gargi Tiwari ◽  
Sugriva Nath Tiwari
Keyword(s):  
Optical Properties ◽  
Liquid Crystal ◽  
Dft Study

Electronic and Optical Properties of CsSnI3−yCly (y = 0, 1, 2, 3) Perovskites: a DFT Study

2018 ◽  
Vol 48 (2) ◽  
pp. 1243-1251 ◽  
Author(s):  
R. Padmavathy ◽  
A. Amudhavalli ◽  
M. Manikandan ◽  
R. Rajeswarapalanichamy ◽  
K. Iyakutti ◽  
...  
Keyword(s):  
Optical Properties ◽  
Dft Study ◽  
Electronic And Optical Properties

Structural, electronic and optical properties of copper-doped SrTiO3 perovskite: A DFT study

2019 ◽  
Vol 552 ◽  
pp. 52-57 ◽  
Author(s):  
Muhammad Rizwan ◽  
Adnan Ali ◽  
Zahid Usman ◽  
N.R. Khalid ◽  
H.B. Jin ◽  
...  
Keyword(s):  
Optical Properties ◽  
Dft Study ◽  
Electronic And Optical Properties

A DFT study of electronic, vibrational and optical properties of gold clusters

2022 ◽  
Vol 54 (2) ◽  
Author(s):  
Tahir Iqbal ◽  
Amna Azam ◽  
Abdul Majid ◽  
Maria Zafar ◽  
Muhammad Shafiq ◽  
...  
Keyword(s):  
Optical Properties ◽  
Gold Clusters ◽  
Dft Study

DFT study of the electronic and optical properties of ternary chalcogenides AlX2Te4

2019 ◽  
Vol 6 (11) ◽  
pp. 116314 ◽  
Author(s):  
Sikander Azam ◽  
Muhammad Irfan ◽  
Zeesham Abbas ◽  
Malika Rani ◽  
Tahira Saleem ◽  
...  
Keyword(s):  
Optical Properties ◽  
Dft Study ◽  
Electronic And Optical Properties
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