Electronic structure tuning of α-SrSi2 by isotropic strain and isoelectronic impurity incorporation: A first-principles study for enhancement of low-temperature thermoelectric performance

Daishi Shiojiri; Tsutomu Iida; Masato Yamaguchi; Naomi Hirayama; Yoji Imai

doi:10.1063/5.0063506

Electronic structure tuning of α-SrSi2 by isotropic strain and isoelectronic impurity incorporation: A first-principles study for enhancement of low-temperature thermoelectric performance

Journal of Applied Physics ◽

10.1063/5.0063506 ◽

2021 ◽

Vol 130 (21) ◽

pp. 215103

Author(s):

Daishi Shiojiri ◽

Tsutomu Iida ◽

Masato Yamaguchi ◽

Naomi Hirayama ◽

Yoji Imai

Keyword(s):

Electronic Structure ◽

Low Temperature ◽

First Principles ◽

Thermoelectric Performance ◽

Impurity Incorporation ◽

First Principles Study

Publisher's Note: “Electronic structure tuning of α-SrSi2 by isotropic strain and isoelectronic impurity incorporation: A first-principles study for enhancement of low-temperature thermoelectric performance” [J. Appl. Phys. 130, 190903 (2021)]

Journal of Applied Physics ◽

10.1063/5.0081637 ◽

2021 ◽

Vol 130 (24) ◽

pp. 249901

Author(s):

Daishi Shiojiri ◽

Tsutomu Iida ◽

Masato Yamaguchi ◽

Naomi Hirayama ◽

Yoji Imai

Keyword(s):

Electronic Structure ◽

Low Temperature ◽

First Principles ◽

Thermoelectric Performance ◽

Impurity Incorporation ◽

First Principles Study

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10.1039/c7ra06455a ◽

2017 ◽

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pp. 38834-38843 ◽

Cited By ~ 11

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M. A. Rafiq ◽

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Keyword(s):

Electronic Structure ◽

Hydrostatic Pressure ◽

Band Gap ◽

First Principles ◽

Thermoelectric Performance ◽

First Principles Study ◽

Induced Changes

Hydrostatic pressure reduces the band gap and increases the ZT value of SnS2.

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10.1063/1.4860996 ◽

2014 ◽

Vol 104 (1) ◽

pp. 012104 ◽

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First Principles ◽

Thermoelectric Performance ◽

First Principles Study

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10.1063/1.4936636 ◽

2015 ◽

Vol 5 (11) ◽

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Keyword(s):

Electronic Structure ◽

Thermoelectric Properties ◽

First Principles ◽

Strain Effect ◽

First Principles Study

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Computational Materials Science ◽

10.1016/j.commatsci.2011.10.042 ◽

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Vol 54 ◽

pp. 287-292 ◽

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Meng-Xue Zeng ◽

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...

Keyword(s):

Electronic Structure ◽

Elastic Properties ◽

First Principles ◽

First Principles Study

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2021 ◽

Author(s):

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Irina Kotova ◽

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Keyword(s):

Electronic Structure ◽

First Principles ◽

First Principles Study ◽

Sodium Diffusion

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Superlattices and Microstructures ◽

10.1016/j.spmi.2021.106944 ◽

2021 ◽

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Neelsh Gupta ◽

Rekha Verma

Keyword(s):

First Principles ◽

Thermoelectric Performance ◽

Biaxial Strain ◽

First Principles Study

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10.1063/1.4872850 ◽

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Author(s):

Hansa Devi ◽

Gitanjali Pagare ◽

S. S. Chouhan ◽

Sankar P. Sanyal

Keyword(s):

Electronic Structure ◽

Elastic Properties ◽

First Principles ◽

First Principles Study

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Science and Technology of Advanced Materials ◽

10.1016/j.stam.2006.12.008 ◽

2007 ◽

Vol 8 (3) ◽

pp. 200-203 ◽

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Author(s):

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Keyword(s):

Carbon Nanotubes ◽

Electronic Structure ◽

First Principles ◽

First Principles Study

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Keyword(s):

Electronic Structure ◽

Thermodynamic Properties ◽

First Principles ◽

Phase System ◽

First Principles Study