Zobrazeno 1 - 10
of 37
pro vyhledávání: '"M. Yazdani-Kachoei"'
Publikováno v:
Scientific Reports, Vol 12, Iss 1, Pp 1-23 (2022)
Abstract We investigate temperature, pressure, and localization dependence of thermoelectric properties, phonon and de Haas–van Alphen (dHvA) frequencies of the anti-ferromagnetic (AFM) CeIn $$_3$$ 3 using density functional theory (DFT) and local,
Externí odkaz:
https://doaj.org/article/2a559e2809ea46079631190e10c7490a
Publikováno v:
Scientific Reports
We investigate temperature, pressure, and localization dependence of thermoelectric properties, phonon and de Haas–van Alphen (dHvA) frequencies of the anti-ferromagnetic (AFM) CeIn\documentclass[12pt]{minimal} \usepackage{amsmath} \usepackage{wasy
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=pmid________::deb34bd9faf8f4bc9e94a583fb30959d
https://pubmed.ncbi.nlm.nih.gov/35027573
https://pubmed.ncbi.nlm.nih.gov/35027573
Publikováno v:
Computational Materials Science. 164:205-217
Recently, CeRhIn5 and CeCoIn5 with very different behaviors at ambient pressure were experimentally measured to exhibit comparable properties after applying pressure or doping impurity. Here, we study the electron charge densities (ECDs) of these com
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::2bad09f374c3f892f31277ea380ebe40
https://doi.org/10.1016/j.commatsci.2019.03.041
https://doi.org/10.1016/j.commatsci.2019.03.041
Publikováno v:
RSC Advances. 9:36182-36197
Experimental evidences show that Ce-based compounds can be good candidates for thermoelectric applications due to their high thermoelectric efficiencies at low temperatures. However, thermoelectric properties have been studied less than the other pro
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::1b2ae82b978fd93571d2bf959b5e65fb
https://doi.org/10.1039/c9ra07859b
https://doi.org/10.1039/c9ra07859b
Publikováno v:
Intermetallics. 93:77-84
In this paper, we explore the structural, magnetic, electronic specific heat, electric field gradient (EFG) as well as quadrupole coupling constant of NpPx3 (Px = Al, Ga, In) by using LDA, GGA, GGA + U and HF-PBEsol. The relativistic effects of elect
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::fb4ccd2a69dfd9ba0de24fb3f9110621
https://doi.org/10.1016/j.intermet.2017.11.012
https://doi.org/10.1016/j.intermet.2017.11.012
Publikováno v:
Intermetallics. 91:95-99
In this paper we explore the electronic charge distribution at different atomic sites in the rare-earth intermetallics RIn3 and RSn3 (R = La, Ce, Pr and Nd) using the analysis of the electric field gradients (EFGs) calculated by the FP-LAPW + lo meth
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::5ce3b85a080bc7f38c589d4fe5f4e22e
https://doi.org/10.1016/j.intermet.2017.08.014
https://doi.org/10.1016/j.intermet.2017.08.014
Publikováno v:
Physica B: Condensed Matter. 526:102-109
In this paper, we explore the structural and magnetic properties as well as electric field gradient (EFG), hyperfine field (HFF) and quadrupole coupling constant in actinide digallide AcGa2 (Ac = U, Np, Pu) using LDA, GGA, LDA+U, GGA+U and hybrid fun
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::eb39e4aaa0f640b161242bf0411be5b4
https://doi.org/10.1016/j.physb.2017.09.052
https://doi.org/10.1016/j.physb.2017.09.052
Publikováno v:
Journal of Electronic Materials. 47:1045-1058
Cubic uranium compounds such as UX3 (X is a non-transition element of groups IIIA or IVA) exhibit highly diverse magnetic properties, including Pauli paramagnetism, spin fluctuation and anti-ferromagnetism. In the present paper, we explore the struct
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::468ff544f42749d6f595c743cb54e721
https://doi.org/10.1007/s11664-017-5811-3
https://doi.org/10.1007/s11664-017-5811-3
Autor:
M. Yazdani-Kachoei, Imad Khan, H. A. Rahnamaye Aliabad, Iftikhar Ahmad, S. Jalali-Asadabadi, Banaras Khan
Publikováno v:
Journal of Alloys and Compounds. 694:253-260
In this paper we explore the electronic nature and thermoelectric properties of filled skutterudites AFe 4 Sb 12 (A Ca, Sr and Ba) by DFT and post-DFT techniques. The calculated results show that the filling of Ca, Sr, and Ba at the empty crystal sit
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::c7bda735c73ac36eb7e487d9660a52b9
https://doi.org/10.1016/j.jallcom.2016.09.308
https://doi.org/10.1016/j.jallcom.2016.09.308
Publikováno v:
RSC advances. 9(62)
Experimental evidences show that Ce-based compounds can be good candidates for thermoelectric applications due to their high thermoelectric efficiencies at low temperatures. However, thermoelectric properties have been studied less than the other pro
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=pmid________::4507dc802bfad0b7100d304e7136451f
https://pubmed.ncbi.nlm.nih.gov/35540618
https://pubmed.ncbi.nlm.nih.gov/35540618