
Next Materials, Год журнала: 2024, Номер 6, С. 100284 - 100284
Опубликована: Авг. 2, 2024
Язык: Английский
Next Materials, Год журнала: 2024, Номер 6, С. 100284 - 100284
Опубликована: Авг. 2, 2024
Язык: Английский
Optical and Quantum Electronics, Год журнала: 2023, Номер 56(3)
Опубликована: Дек. 29, 2023
Язык: Английский
Процитировано
4Results in Materials, Год журнала: 2024, Номер 22, С. 100568 - 100568
Опубликована: Март 27, 2024
Here we report the structural, elastic, bonding, thermo-mechanical, optoelectronic and superconducting state properties of recently discovered XIr3 (X = La, Th) superconductors utilizing density functional theory (DFT) using two different exchange-correlations functionals. The thermal optical these compounds are investigated for first time. calculated lattice parameters in reasonable agreement to those found literature. In ground state, both mechanically stable possess highly ductile character, high machinability, low Debye temperature, bond hardness significantly melting point. conductivities be very which suggests that they can used insulation purpose. population analysis charge distribution map confirm presence ionic covalent bonds with playing dominant roles. band structure DOS profiles indicate metallic character compounds. It is also from profile Ir 5d-states dominate near Fermi level. Unlike significant anisotropy observed elastic properties, all constants exhibit almost isotropic behavior. parameters' correspond well electronic features. We have estimated transition temperature (Tc) this work. values Tc LaIr3 ThIr3 4.91 K 5.01 K, respectively. compared contrasted physical study.
Язык: Английский
Процитировано
1Solid State Sciences, Год журнала: 2024, Номер 152, С. 107551 - 107551
Опубликована: Апрель 26, 2024
Язык: Английский
Процитировано
1Nuclear Materials and Energy, Год журнала: 2024, Номер 42, С. 101860 - 101860
Опубликована: Дек. 30, 2024
Язык: Английский
Процитировано
1Next Materials, Год журнала: 2024, Номер 6, С. 100284 - 100284
Опубликована: Авг. 2, 2024
Язык: Английский
Процитировано
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