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By combining ab initio simulations including an on-site Coulomb repulsion term and Boltzmann theory, we explore the thermoelectric properties of (LaNiO$_3$)$_n$/(LaAlO$_3$)$_n$(001) superlattices ($n=1,3$) and identify a strong dependence…

Materials Science · Physics 2018-05-17 Benjamin Geisler , Rossitza Pentcheva

The superconductor Sr4V2O6Fe2As2 with transition temperature at 37.2 K has been fabricated. It has a layered structure with the space group of p4/nmm, and with the lattice constants a = 3.9296Aand c = 15.6732A. The observed large…

Superconductivity · Physics 2015-05-13 Xiyu Zhu , Fei Han , Gang Mu , Peng Cheng , Bing Shen , Bin Zeng , Hai-Hu Wen

Superlattice-like phase change memory (SL-PCM) promises lower switching current than conventional PCM based on Ge2Sb2Te5 (GST). However, a fundamental understanding of SL-PCM requires detailed characterization of the interfaces within such…

Recently, it has been found that crystalline tin selenide (SnSe) holds great potential as a thermoelectric material due to its ultralow thermal conductivity and moderate electronic transport performance. As thermoelectric application…

Applied Physics · Physics 2019-02-04 Shouhang Li , Zhen Tong , Hua Bao

We observed a large decrease of Tc by no more than 3 at.% of Zn doped to the optimized superconductor LaFeAsO0.85 (Tc = 26 K), confirmed by measurements of electrical resistivity, magnetic susceptibility, specific heat, M\"ossbauer…

We present measurements of resistivity and thermopower of Fe1+xTe1-ySey single crystalline samples with y=0, 0.1, 0.2, 0.3 and 0.45 in zero field and in a magnetic field B=8T. We propose a qualitative analysis of the temperature behavior of…

Superconductivity · Physics 2009-12-10 I. Pallecchi , G. Lamura , M. Tropeano , M. Putti , R. Viennois , E. Giannini , D. Van der Marel

We explicitly consider both phonon energy shifts and broadening arising from both cubic and quartic anharmonicities, as well as diagonal/non-diagonal terms of heat flux operators in thermal conductivity. Our findings show that the strong…

Materials Science · Physics 2024-09-10 Jincheng Yue , Jiongzhi Zheng , Junda Li , Xingchen Shen , Wenling Ren , Yanhui Liu , Tian Cui

We have presented the structural, elastic, optoelectronic and transport properties of Sr3SnO under pressure by using first principles method. The application of hydrostatic pressure causes charge transfer from Sr(5s) orbital to Sn(5p) and…

Materials Science · Physics 2018-02-06 Enamul Haque , M. Anwar Hossain

Although there are enormous numbers of high-temperature thermoelectric materials present, designing a near-room-temperature especially n-type thermoelectric material with high zT is extremely challenging. Generally, pristine Ag2Se exhibits…

Materials Science · Physics 2021-03-30 Raju K Biswas , Swapan K Pati

By using the semi-wet synthesis method, lead-free ferroelectric materials Ba0.9Sr0.1Ti1-xSnxO3 with x = 0, 0.02, 0.05, and 0.10 (abbreviated as BSTS) were prepared and their structural, electric and electrocaloric properties were…

The effective mass is one of the main factors for enlarging the Seebeck coefficient and electronic conductivity of SrTiO3-based thermoelectric materials [1,2]. The goal of this paper is to clarify, how superlattices can change the effective…

Materials Science · Physics 2008-08-14 Wilfried Wunderlich , Hiromichi Ohta , Kunichi Koumoto

$\beta$-Ag$_2$Se is a promising material for room temperature thermoelectric applications and magneto-resistive sensors. However, no attention was paid earlier to the hysteresis in the temperature dependence of resistivity ($\rho$($T$)).…

Materials Science · Physics 2021-10-27 L. S. Sharath Chandra , SK. Ramjan , Soma Banik , Archna Sagdeo , M. K. Chattopadhyay

In this study, we calculate the $T$=300 K scattering and thermoelectric transport properties of rhombohedral GeTe using first-principles modeling. The room-temperature phase of GeTe has a layered structure, with cross-plane and in-plane…

Materials Science · Physics 2019-08-07 Vahid Askarpour , Jesse Maassen

In this study, we have reported electronic structure, lattice dynamics, and thermoelectric (TE) transport properties of a new family of pentanary substituted TiNiSn systems using the 18 valence electron count (VEC) rule. From our calculated…

Materials Science · Physics 2021-10-20 Mukesh K. Choudhary , P. Ravindran

CaSb2 is a topological nodal-line semimetal that becomes superconducting below 1.6 K, providing an ideal platform to investigate the interplay between topologically nontrivial electronic bands and superconductivity. In this work, we…

Superconductivity · Physics 2023-01-04 Weiyin Duan , Jiawen Zhang , Rohit Kumar , Hang Su , Zhiyong Nie , Ye Chen , Chao Cao , Yu Song , Huiqiu Yuan

We present an investigation of the thermoelectric properties of cubic perovskite SrTiO3. The results are derived from a combination of calculated transport functions obtained from Boltzmann transport theory in the constant scattering time…

Materials Science · Physics 2016-05-27 Jifeng Sun , David J. Singh

We have investigated the electronic and thermoelectric properties of half-Heusler alloys NiTZ (T = Sc, and Ti; Z = P, As, Sn, and Sb) having 18 valence electron. Calculations are performed by means of density functional theory and Boltzmann…

We study role of site substitutions at In and Te site in In2Te5 on the thermoelectric behavior. Single crystals with compositions In2(Te1-xSex)5 (x = 0, 0.05, 0.10) and Fe0.05In1.95(Te0.90Se0.10)5 were prepared using modified…

Materials Science · Physics 2016-08-24 Anup V. Sanchela , Ajay D. Thakur , C. V. Tomy

The increase of a thermoelectric material's figure of merit (ZT value) is limited by the interplay of the transport coefficients. Here we report the greatly enhanced thermoelectric performance of a ZrS2 monolayer by the biaxial tensile…

Mesoscale and Nanoscale Physics · Physics 2016-07-14 H. Y. Lv , W. J. Lu , D. F. Shao , H. Y. Lu , Y. P. Sun

Using optical spectroscopy, we investigated the electrodynamic properties of Nb:SrTiO3/SrTiO3 superlattices. In these superlattices, a large enhancement of the Seebeck coefficient (S) has been reported with decreasing Nb:SrTiO3 layer…

Strongly Correlated Electrons · Physics 2010-07-09 Woo Seok Choi , Hiromichi Ohta , Soon Jae Moon , Yun Sang Lee , Tae Won Noh
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