Electronic Structure and Optical Absorption Spectra of C-Cr Co-Doped Anatase TiO2 Based on First Principles

physica status solidi (b) ◽

10.1002/pssb.201700616 ◽

2018 ◽

Vol 255 (6) ◽

pp. 1700616 ◽

Author(s):

Cheng Liu ◽

Yumin Song ◽

Xiaohua Yu ◽

Jianxiong Liu ◽

Jiushuai Deng

Keyword(s):

Electronic Structure ◽

Optical Absorption ◽

Absorption Spectra ◽

First Principles ◽

Anatase Tio2 ◽

Optical Absorption Spectra ◽

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Analysis of the electronic structure of polyacetylene based on its optical absorption spectra

Synthetic Metals ◽

10.1016/0379-6779(91)91763-z ◽

1991 ◽

Vol 39 (3) ◽

pp. 367-378 ◽

Author(s):

V.M Kobryansky ◽

E.A Tereshko

Keyword(s):

Electronic Structure ◽

Optical Absorption ◽

Absorption Spectra ◽

Optical Absorption Spectra

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Optical absorption spectra and electronic structure of Bi2(La1−xSrx)2CuOy

Physica C Superconductivity ◽

10.1016/s0921-4534(98)00189-0 ◽

1998 ◽

Vol 302 (2-3) ◽

pp. 229-243 ◽

Author(s):

Takanori Itoh ◽

Kazuo Fueki ◽

Yasumoto Tanaka ◽

Hideo Ihara

Keyword(s):

Electronic Structure ◽

Optical Absorption ◽

Absorption Spectra ◽

Optical Absorption Spectra

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Correction to “Systematic First-Principles Configuration-Interaction Calculations of Linear Optical Absorption Spectra in Silicon Hydrides: Si2H2n (n = 1–3)”

The Journal of Physical Chemistry A ◽

10.1021/acs.jpca.9b09606 ◽

2019 ◽

Vol 123 (44) ◽

pp. 9635-9635

Author(s):

Pritam Bhattacharyya ◽

Deepak Kumar Rai ◽

Alok Shukla

Keyword(s):

Optical Absorption ◽

Absorption Spectra ◽

Configuration Interaction ◽

First Principles ◽

Optical Absorption Spectra ◽

Silicon Hydrides ◽

Linear Optical ◽

Configuration Interaction Calculations

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Optical Absorption Spectra Calculated from a First-Principles Wave Function Theory for Solids: Transcorrelated Method Combined with Configuration Interaction Singles

Journal of Chemical Theory and Computation ◽

10.1021/ct500485b ◽

2014 ◽

Vol 10 (9) ◽

pp. 4098-4103 ◽

Author(s):

Masayuki Ochi ◽

Shinji Tsuneyuki

Keyword(s):

Wave Function ◽

Optical Absorption ◽

Absorption Spectra ◽

Configuration Interaction ◽

First Principles ◽

Function Theory ◽

Optical Absorption Spectra

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Static polarizabilities and optical absorption spectra of boron clusters (n = 2–20, 38 and 40) using first principles

Computational and Theoretical Chemistry ◽

10.1016/j.comptc.2017.12.013 ◽

2018 ◽

Vol 1125 ◽

pp. 54-62 ◽

Author(s):

Balasaheb J. Nagare ◽

Sunil Chavan ◽

Vaishali Bambole

Keyword(s):

Optical Absorption ◽

Absorption Spectra ◽

First Principles ◽

Optical Absorption Spectra ◽

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Optical Absorption Spectra and Polarizabilities of Silicon Carbide Nanotubes: A First Principles Study

The Journal of Physical Chemistry C ◽

10.1021/jp074484y ◽

2007 ◽

Vol 111 (51) ◽

pp. 18864-18870 ◽

Author(s):

Lu Wang ◽

Jing Lu ◽

Guangfu Luo ◽

Wei Song ◽

Lin Lai ◽

...

Keyword(s):

Silicon Carbide ◽

Optical Absorption ◽

Absorption Spectra ◽

First Principles ◽

Optical Absorption Spectra ◽

First Principles Study ◽

Silicon Carbide Nanotubes

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First-Principles Calculations of the Urbach Tail in the Optical Absorption Spectra of Silica Glass

Physical Review Letters ◽

10.1103/physrevlett.106.027401 ◽

2011 ◽

Vol 106 (2) ◽

Author(s):

B. Sadigh ◽

P. Erhart ◽

D. Åberg ◽

A. Trave ◽

E. Schwegler ◽

...

Keyword(s):

Optical Absorption ◽

Absorption Spectra ◽

First Principles ◽

Silica Glass ◽

Optical Absorption Spectra ◽

First Principles Calculations ◽

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First-principles calculations of 4f–5d optical absorption spectra in BaMgAl10O17:Eu

Journal of Luminescence ◽

10.1016/j.jlumin.2006.01.110 ◽

2007 ◽

Vol 122-123 ◽

pp. 104-106 ◽

Author(s):

H. Toyoshima ◽

S. Watanabe ◽

K. Ogasawara ◽

H. Yoshida

Keyword(s):

Optical Absorption ◽

Absorption Spectra ◽

First Principles ◽

Optical Absorption Spectra ◽

First Principles Calculations

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Electronic structure and optical absorption spectra of CdSe covered with ZnSe and ZnS epilayers

Solid State Communications ◽

10.1016/j.ssc.2005.10.029 ◽

2006 ◽

Vol 137 (6) ◽

pp. 332-337 ◽

Author(s):

So Jeong Yun ◽

Geunsik Lee ◽

Jai Sam Kim ◽

Seung Koo Shin ◽

Young-Gui Yoon

Keyword(s):

Electronic Structure ◽

Optical Absorption ◽

Absorption Spectra ◽

Optical Absorption Spectra

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Electronic Structure and TDDFT Optical Absorption Spectra of Silver Nanorods†

The Journal of Physical Chemistry A ◽

10.1021/jp811075u ◽

2009 ◽

Vol 113 (16) ◽

pp. 4445-4450 ◽

Author(s):

Hannah E. Johnson ◽

Christine M. Aikens

Keyword(s):

Electronic Structure ◽

Optical Absorption ◽

Absorption Spectra ◽

Optical Absorption Spectra ◽

Silver Nanorods

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