| 2. | Vrishali Sonar, Piotr Trocha Non-local thermoelectric transport in multi-terminal quantum dot hybrid system Journal of Magnetism and Magnetic Materials, 593 , pp. 171745, 2024. Abstract | Links | BibTeX @article{Sonar2024,
title = {Non-local thermoelectric transport in multi-terminal quantum dot hybrid system},
author = {Vrishali Sonar and Piotr Trocha},
url = {https://www.sciencedirect.com/science/article/pii/S0304885324000350?via%3Dihub},
doi = {10.1016/j.jmmm.2024.171745},
year = {2024},
date = {2024-03-01},
journal = {Journal of Magnetism and Magnetic Materials},
volume = {593},
pages = {171745},
abstract = {The heat and charge transport is studied in a hybrid multi-terminal device consisting of one metallic, one ferromagnetic and a superconducting lead coupled to quantum dot. The basic thermoelectric properties of the system are examined using non-equilibrium Green’s function method with finite on-dot Coulomb repulsion within Hubbard-I approximation. Local and non-local transport coefficients including electrical and thermal conductance, Seebeck coefficient calculated in the linear response regime. Main objective is to analyze effect of superconductor coupling and ferromagnet’s spin polarization on thermoelectric transport and how ferromagnetic lead modifies it. We also studied the role of different electron tunneling types, i. e. Andreev reflection, quasi-particle and normal single particle tunneling processes on thermoelectric properties of the considered system.},
keywords = {},
pubstate = {published},
tppubtype = {article}
}
The heat and charge transport is studied in a hybrid multi-terminal device consisting of one metallic, one ferromagnetic and a superconducting lead coupled to quantum dot. The basic thermoelectric properties of the system are examined using non-equilibrium Green’s function method with finite on-dot Coulomb repulsion within Hubbard-I approximation. Local and non-local transport coefficients including electrical and thermal conductance, Seebeck coefficient calculated in the linear response regime. Main objective is to analyze effect of superconductor coupling and ferromagnet’s spin polarization on thermoelectric transport and how ferromagnetic lead modifies it. We also studied the role of different electron tunneling types, i. e. Andreev reflection, quasi-particle and normal single particle tunneling processes on thermoelectric properties of the considered system. |
| 1. | Vrishali Sonar, Rohan Dehankar, K. P. Vijayalakshmi, Natalio Mingo, Ankita Katre Site-independent strong phonon-vacancy scattering in high-temperature ceramics ZrB2 and HfB2 Phys. Rev. Materials, 6 , pp. 065403, 2022. Abstract | Links | BibTeX @article{Sonar2022,
title = {Site-independent strong phonon-vacancy scattering in high-temperature ceramics ZrB2 and HfB2},
author = {Vrishali Sonar and Rohan Dehankar and K. P. Vijayalakshmi and Natalio Mingo and Ankita Katre},
url = {https://journals.aps.org/prmaterials/abstract/10.1103/PhysRevMaterials.6.065403},
doi = {10.1103/PhysRevMaterials.6.065403},
year = {2022},
date = {2022-06-10},
journal = {Phys. Rev. Materials},
volume = {6},
pages = {065403},
abstract = {Similar effects of metal and boron vacancies on phonon scattering and lattice thermal conductivity (κl) of ZrB2 and HfB2 are reported. These defects challenge the conventional understanding that associates larger impacts to bigger defects. We find the underlying reason to be a strong local perturbation caused by boron vacancy that substantially changes the interatomic force constants. In contrast, a long ranged but weaker perturbation is seen in the case of metal vacancy. We show that these behaviors originate from a mixed metallic and covalent bonding nature in the metal diborides. The thermal transport calculations are performed in a complete ab initio framework based on Boltzmann transport equation and density functional theory. Phonon-vacancy scattering is calculated using ab initio Green's function approach. Effects of natural isotopes and grain boundaries on κl are also systematically investigated, however we find an influential role of vacancies to explain large variations seen in the experiments. We further report a two-order of magnitude difference between the amorphous and pure-crystal limits. Our results outline significant material design aspects for these multifunctional high-temperature ceramics.},
keywords = {},
pubstate = {published},
tppubtype = {article}
}
Similar effects of metal and boron vacancies on phonon scattering and lattice thermal conductivity (κl) of ZrB2 and HfB2 are reported. These defects challenge the conventional understanding that associates larger impacts to bigger defects. We find the underlying reason to be a strong local perturbation caused by boron vacancy that substantially changes the interatomic force constants. In contrast, a long ranged but weaker perturbation is seen in the case of metal vacancy. We show that these behaviors originate from a mixed metallic and covalent bonding nature in the metal diborides. The thermal transport calculations are performed in a complete ab initio framework based on Boltzmann transport equation and density functional theory. Phonon-vacancy scattering is calculated using ab initio Green's function approach. Effects of natural isotopes and grain boundaries on κl are also systematically investigated, however we find an influential role of vacancies to explain large variations seen in the experiments. We further report a two-order of magnitude difference between the amorphous and pure-crystal limits. Our results outline significant material design aspects for these multifunctional high-temperature ceramics. |
