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First‐principles study on structural, electronic, elastic, mechanical, thermodynamic, and thermoelectric properties of RbSnX3 (X = F, Cl, and Br) perovskites
First‐principles study on structural, electronic, elastic, mechanical, thermodynamic, and thermoelectric properties of RbSnX3 (X = F, Cl, and Br) perovskites
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First‐principles study on structural, electronic, elastic, mechanical, thermodynamic, and thermoelectric properties of RbSnX3 (X = F, Cl, and Br) perovskites

Kumari, Preeti ; Sharma, Ramesh ; Lilhore, Umesh ; Khenata, Rabah ; Srivastava, Vipul

International journal of energy research, 2022-12, Vol.46 (15), p.23893-23907 [Periódico revisado por pares]

Chichester, UK: John Wiley & Sons, Inc

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First-principles calculation of magnetic, structural, dynamic, electronic, elastic, thermodynamic and thermoelectric properties of Co2ZrZ (Z = Al, Si) Heusler alloys
First-principles calculation of magnetic, structural, dynamic, electronic, elastic, thermodynamic and thermoelectric properties of Co2ZrZ (Z = Al, Si) Heusler alloys
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First-principles calculation of magnetic, structural, dynamic, electronic, elastic, thermodynamic and thermoelectric properties of Co2ZrZ (Z = Al, Si) Heusler alloys

Sâad Essaoud, S. ; Jbara, Ahmed S.

Journal of magnetism and magnetic materials, 2021-08, Vol.531, p.167984, Article 167984 [Periódico revisado por pares]

Amsterdam: Elsevier B.V

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3
Exploration of structural, electronic, optical, mechanical, thermoelectric, and thermodynamic properties of XInO3 (X = As, Sb) compounds for energy harvesting applications
Exploration of structural, electronic, optical, mechanical, thermoelectric, and thermodynamic properties of XInO3 (X = As, Sb) compounds for energy harvesting applications
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Exploration of structural, electronic, optical, mechanical, thermoelectric, and thermodynamic properties of XInO3 (X = As, Sb) compounds for energy harvesting applications

Manzoor, Mumtaz ; Iqbal, Muhammad Waqas ; Sharma, Ramesh ; Abraham, Jisha Annie

International journal of energy research, 2022-08, Vol.46 (10), p.13409-13423 [Periódico revisado por pares]

Chichester, UK: John Wiley & Sons, Inc

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4
Insight into structural, elastic, phonon, and thermodynamic properties of α-sulfur and energy-related sulfides: a comprehensive first-principles study
Insight into structural, elastic, phonon, and thermodynamic properties of α-sulfur and energy-related sulfides: a comprehensive first-principles study
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Insight into structural, elastic, phonon, and thermodynamic properties of α-sulfur and energy-related sulfides: a comprehensive first-principles study

Shang, ShunLi ; Wang, Yi ; Guan, Pinwen ; Wang, William Y ; Fang, Huazhi ; Anderson, Tim ; Liu, Zi-Kui

Journal of materials chemistry. A, Materials for energy and sustainability, 2015-03, Vol.3 (15), p.8002-8014 [Periódico revisado por pares]

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5
Electronic structure, mechanical, thermoelectric, optical, and thermodynamic properties of yttrium‐based quaternary Heusler alloys
Electronic structure, mechanical, thermoelectric, optical, and thermodynamic properties of yttrium‐based quaternary Heusler alloys
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Electronic structure, mechanical, thermoelectric, optical, and thermodynamic properties of yttrium‐based quaternary Heusler alloys

Singh, Srishti ; Gupta, Dinesh C.

International journal of energy research, 2019-11, Vol.43 (14), p.8633-8648, Article er.4860 [Periódico revisado por pares]

Bognor Regis: Hindawi Limited

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6
First principles investigation of binary intermetallics in Mg–Al–Ca–Sn alloy: Stability, electronic structures, elastic properties and thermodynamic properties
First principles investigation of binary intermetallics in Mg–Al–Ca–Sn alloy: Stability, electronic structures, elastic properties and thermodynamic properties
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First principles investigation of binary intermetallics in Mg–Al–Ca–Sn alloy: Stability, electronic structures, elastic properties and thermodynamic properties

WANG, Feng ; SUN, Shi-jie ; YU, Bo ; ZHANG, Feng ; MAO, Ping-li ; LIU, Zheng

Transactions of Nonferrous Metals Society of China, 2016-01, Vol.26 (1), p.203-212 [Periódico revisado por pares]

Elsevier Ltd

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7
Electronic, elastic, thermodynamic properties and structure disorder of γ-AlON solid solution from ab initio calculations
Electronic, elastic, thermodynamic properties and structure disorder of γ-AlON solid solution from ab initio calculations
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Electronic, elastic, thermodynamic properties and structure disorder of γ-AlON solid solution from ab initio calculations

Wang, Yuezhong ; Lu, Tiecheng ; Zhang, Rongshi ; Jiang, Shengli ; Qi, Jianqi ; Wang, Ying ; Chen, Qingyun ; Miao, Naihua ; He, Duanwei

Journal of alloys and compounds, 2013-01, Vol.548, p.228-234 [Periódico revisado por pares]

Kidlington: Elsevier B.V

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8
A first-principles study on the structural, elastic, electronic, optical, lattice dynamical, and thermodynamic properties of zinc-blende CdX (X=S, Se, and Te)
A first-principles study on the structural, elastic, electronic, optical, lattice dynamical, and thermodynamic properties of zinc-blende CdX (X=S, Se, and Te)
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A first-principles study on the structural, elastic, electronic, optical, lattice dynamical, and thermodynamic properties of zinc-blende CdX (X=S, Se, and Te)

Guo, Lei ; Zhang, Shengtao ; Feng, Wenjiang ; Hu, Ge ; Li, Wenpo

Journal of alloys and compounds, 2013-12, Vol.579, p.583-593 [Periódico revisado por pares]

Kidlington: Elsevier B.V

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9
First-principle calculations of structural, elastic and thermodynamic properties of Fe–B compounds
First-principle calculations of structural, elastic and thermodynamic properties of Fe–B compounds
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First-principle calculations of structural, elastic and thermodynamic properties of Fe–B compounds

Li, Liu-Hui ; Wang, Wei-Li ; Hu, Liang ; Wei, Bing-Bo

Intermetallics, 2014-03, Vol.46, p.211-221 [Periódico revisado por pares]

Elsevier Ltd

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10
Electronic, optical, elastic, thermoelectric and thermodynamic properties of the spinel oxides ZnRh2O4 and CdRh2O4
Electronic, optical, elastic, thermoelectric and thermodynamic properties of the spinel oxides ZnRh2O4 and CdRh2O4
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Electronic, optical, elastic, thermoelectric and thermodynamic properties of the spinel oxides ZnRh2O4 and CdRh2O4

Bouhemadou, A. ; Allali, D. ; Boudiaf, K. ; Al Qarni, B. ; Bin-Omran, S. ; Khenata, R. ; Al-Douri, Y.

Journal of alloys and compounds, 2019-02, Vol.774, p.299-314 [Periódico revisado por pares]

Elsevier B.V

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