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Electric and magnetic polarizabilities of hexagonal Ln(2)CuTiO(6)(Ln = Y, Dy, Ho, Er, and Yb)

IR@CGCRI: CSIR-Central Glass and Ceramic Research Institute, Kolkata

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Title Electric and magnetic polarizabilities of hexagonal Ln(2)CuTiO(6)(Ln = Y, Dy, Ho, Er, and Yb)
 
Creator Choudhury, Debraj
Hazarika, Abhijit
Venimadhav, Adyam
Kakarla, Chandrasekhar
Delaney, Kris T
Sujatha Devi, P
Mondal, P
Nirmala, R
Gopalakrishnan, J
Spaldin, Nicola A
Waghmare, Umesh V
Sarma, D D
 
Subject Electronics
 
Description We investigated the rare-earth transition-metal oxide series, Ln(2)CuTiO(6) (Ln = Y, Dy, Ho, Er, and Yb), crystallizing in the hexagonal structure with noncentrosymmetric P6(3)cm space group for possible occurrences of multiferroic properties. Our results show that while these compounds, except Ln = Y, exhibit a low-temperature antiferromagnetic transition due to the ordering of the rare-earth moments, the expected ferroelectric transition is frustrated by the large size difference between Cu and Ti at the B site. Interestingly, this leads these compounds to attain a rare and unique combination of desirable paraelectric properties with high dielectric constants, low losses, and weak temperature and frequency dependencies. First-principles calculations establish these exceptional properties result from a combination of two effects. A significant difference in the MO(5) polyhedral sizes for M = Cu and M = Ti suppress the expected cooperative tilt pattern of these polyhedra, required for the ferroelectric transition, leading to relatively large values of the dielectric constant for every compound investigated in this series. Additionally, it is shown that the majority contribution to the dielectric constant arises from intermediate-frequency polar vibrational modes, making it relatively stable against any temperature variation. Changes in the temperature stability of the dielectric constant among different members of this series are shown to arise from changes in relative contributions from soft polar modes.
 
Publisher AMER PHYSICAL SOC
 
Date 2010-10
 
Type Article
PeerReviewed
 
Format application/pdf
 
Identifier http://cgcri.csircentral.net/634/1/sujatha2'10.pdf
Choudhury, Debraj and Hazarika, Abhijit and Venimadhav, Adyam and Kakarla, Chandrasekhar and Delaney, Kris T and Sujatha Devi, P and Mondal, P and Nirmala, R and Gopalakrishnan, J and Spaldin, Nicola A and Waghmare, Umesh V and Sarma, D D (2010) Electric and magnetic polarizabilities of hexagonal Ln(2)CuTiO(6)(Ln = Y, Dy, Ho, Er, and Yb). PHYSICAL REVIEW B, 82 (13). Article No.-134203. ISSN 1098-0121
 
Relation http://cgcri.csircentral.net/634/