Abstract
The present study demonstrates the reduction in the dielectric loss at room temperature from 0.149 to 0.027 in the composite of (NdFeO3)0.1−(Ba0.7Sr0.3TiO3)0.9 as compared to the undoped Ba0.7Sr0.3TiO3 and correlates with the charge compensation due to the ionic substitutions for both A site (NdBa) and B (FeTi) site generated excess electrons, localized hole states and robust oxygen vacancies (\({V}_{O}\)) along with different cationic oxidation states. The \({V}_{O}\) mediated F center charge transfer mechanism i.e., bound magnetic polaronic behaviour and defect complex generated between acceptors and ionized \({V}_{O}\) reduce electrical conductivity and loss factor. The presence of weak ferromagnetism in the M-H loop reconfirms the F center exchange mechanism in mixed phase symmetry. The activation energy calculated from impedance spectroscopy, electrical modulus and electrical conductivity analysis supports the presence of doubly ionized \({V}_{O}\). Further, density functional theory based first principle calculation manifests that the impurity induced depopulation of valence band edge electrons into a single spin up channel which distorts TiO6 octahedra with fluctuating bond length and Ti 3d eg orbital splitting observed in decomposed density of states for accommodating excess electrons. These trapped and accommodated electrons reduce the effective electron concentration which in turn decreases the electrical conductivity and loss factor.
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24 September 2021
A Correction to this paper has been published: https://doi.org/10.1007/s10854-021-07043-6
References:
N. Setter, D. Damjanovic, L. Eng, G. Fox, S. Gevorgian, S. Hong, A. Kingon, H. Kohlstedt, N. Y. Park, G. B. Stephenson, I. Stolitchnov, A. K. Taganstev, D. V. Taylor, T. Yamada, and S. Streiffer, J. Appl. Phys. 100, (2006).
M.D. Maeder, D. Damjanovic, N. Setter, J. Electroceram. 13, 385 (2004)
H. Inoue, H. Yoon, T.A. Merz, A.G. Swartz, S.S. Hong, Y. Hikita, H.Y. Hwang, Appl. Phys. Lett. 114, 231605 (2019)
T. Yajima, M. Minohara, C. Bell, H.Y. Hwang, Y. Hikita, Appl. Phys. Lett. 113, 221603 (2018)
A. Kaur, A. Singh, L. Singh, S.K. Mishra, P.D. Babu, K. Asokan, S. Kumar, C.L. Chen, K.S. Yang, D.H. Wei, RSC Adv. 6, 112363 (2016)
L. Curecheriu, M.T. Buscaglia, V. Buscaglia, Z. Zhao, L. Mitoseriu, Appl. Phys. Lett. 97, 1 (2010)
F. A. Ismail, R. Aina, M. Osman, M. S. Idris, 090005, (2016).
S. Choudhury, S. Akter, M. Rahman, A. Bhuiyan, S. Rahman, N. Khatun, M. Hossain, J. Bangladesh Acad. Sci. 32, (1970).
Y.J. Kim, J.W. Hyun, Appl. Sci. Converg. Technol. 26, 143 (2017)
Z. Li, H. Fan, J. Phys. D Appl. Phys. 42, 075415 (2009)
M. Arshad, H. Du, M.S. Javed, A. Maqsood, I. Ashraf, S. Hussain, W. Ma, H. Ran, Ceram. Int. 46, 2238 (2020)
S.B. Herner, F.A. Selmi, V.V. Varadan, V.K. Varadan, Mater. Lett. 15, 317 (1993)
Z.Q. Wang, Y.S. Lan, Z.Y. Zeng, X.R. Chen, Q.F. Chen, Solid State Commun. 288, 10 (2019)
A. Singh, A. Gupta, R. Chatterjee, Appl. Phys. Lett. 93, 2006 (2008)
T. Murtaza, M.S. Khan, J. Ali, T. Hussain, K. Asokan, J. Mater. Sci. Mater. Electron. 29, 18573 (2018)
I. Sosnowsk, E. Steichelea, A. Hewatc, Phys. B+ C 136, 394 (1986)
K. Mathew, R. Sundararaman, K. Letchworth-Weaver, T.A. Arias, R.G. Hennig, J. Chem. Phys. 140, 84106 (2014)
F. Han, Problems in Solid State Physics with Solutions (World Scientific Publishing Company, 2011).
J.P. Perdew, K. Burke, M. Ernzerhof, Phys. Rev. Lett. 77, 3865 (1996)
G. Kresse, J. Furthmüller, Phys. Rev. B–Condens. Matter Mater. Phys. 54, 11169 (1996)
H.J. Monkhorst, J.D. Pack, Phys. Rev. B 13, 5188 (1976)
A.I. Liechtenstein, V.I. Anisimov, J. Zaanen, Phys. Rev. B 52, R5467 (1995)
S.L. Dudarev, G.A. Botton, S.Y. Savrasov, C.J. Humphreys, A.P. Sutton, Phys. Rev. B 57, 1505 (1998)
V. Kumar, A. Bhogra, M. Bala, S.C. Haw, C.L. Chen, C.L. Dong, K. Asokan, S. Annapoorni, Phys. Rev. B 103, 24104 (2021)
N.A. Rejab, S. Sreekantan, K. Abd Razak, Z.A. Ahmad, J. Mater. Sci. Mater. Electron. 22, 167 (2011)
Z. Yao, H. Liu, Y. Liu, Z. Wu, Z. Shen, Y. Liu, M. Cao, Mater. Chem. Phys. 109, 475 (2008)
N. V Dang, T. D. Thanh, L. V Hong, V. D. Lam, T. Phan, J. Appl. Phys. 110, (2011).
S. Rajan, P.M.M. Gazzali, G. Chandrasekaran, Spectrochim Acta Part A Mol. Biomol. Spectrosc. 171, 80 (2017)
N.V. Dang, N.T. Dung, P.T. Phong, I.-J. Lee, Phys. B Condens. Matter 457, 103 (2015)
A. El Ghandouri, S. Sayouri, T. Lamcharfi, L. Hajji, J. Mater. Enviorn. Sci. 8, 4945 (2017)
R.S. Katiyar, M. Jain, Y.U.I. Yuzyuk, Ferroelectrics 303, 101 (2004)
L. Huang, Z. Chen, J. D. Wilson, S. Banerjee, R. D. Robinson, I. P. Herman, R. Laibowitz, and S. O’Brien, J. Appl. Phys. 100, (2006).
A. Kaur, L. Singh, K. Asokan, Ceram. Int. 44, 3751 (2018)
A. Shukla, R.N.P. Choudhary, Phys. B Condens. Matter 406, 2492 (2011)
L. Lv, J.P. Zhou, Q. Liu, G. Zhu, X.Z. Chen, X.B. Bian, P. Liu, Phys. E Low-Dimens. Syst. Nanostr. 43, 1798 (2011)
T. Badapanda, S. Sarangi, S. Parida, B. Behera, B. Ojha, S. Anwar, J. Mater. Sci. Mater. Electron. 26, 3069 (2015)
Y.C. Huang, S.S. Chen, W.H. Tuan, J. Am. Ceram. Soc. 90, 1438 (2007)
P.P. Khirade, S.D. Birajdar, A.V. Raut, K.M. Jadhav, Ceram. Int. 42, 12441 (2016)
V.A. Khomchenko, D.A. Kiselev, J.M. Vieira, A.L. Kholkin, M.A. Sá, Y.G. Pogorelov, Appl. Phys. Lett. 90, 242901 (2007)
J.M.D. Coey, A.P. Douvalis, C.B. Fitzgerald, M. Venkatesan, Appl. Phys. Lett. 84, 1332 (2004)
B. Zhang, Z. Quan, T. Zhang, T. Guo, and S. Mo, J. Appl. Phys. 101, (2007).
B.S. Norgren, M.A.J. Somers, J.H.W. De Wit, Surf. Interface Anal. 21, 378 (1994)
F. Gheorghiu, M. Simenas, C.E. Ciomaga, M. Airimioaei, V. Kalendra, J. Banys, M. Dobromir, S. Tascu, L. Mitoseriu, Ceram. Int. 43, 9998 (2017)
C. Xu, Y. Xia, Z. Liu, X. Meng, J. Phys. D. Appl. Phys. 42, 85302 (2009)
Y. Shuai, S. Zhou, D. Bürger, H. Reuther, I. Skorupa, V. John, M. Helm, H. Schmidt, J. Appl. Phys. 109, (2011).
Y. Lv, W. Yao, X. Ma, C. Pan, R. Zong, Y. Zhu, Catal. Sci. Technol. 3, 3136 (2013)
H. Tan, Z. Zhao, W. Zhu, E.N. Coker, B. Li, M. Zheng, W. Yu, H. Fan, Z. Sun, A.C.S. Appl, Mater. Interfaces 6, 19184 (2014)
Q. Ke, X. Lou, Y. Wang, J. Wang, Phys. Rev. B 82, 24102 (2010)
T. Chakraborty, S. Ray, M. Itoh, Phys. Rev. B 83, 144407 (2011)
R.V.K. Mangalam, N. Ray, U.V. Waghmare, A. Sundaresan, C.N.R. Rao, Solid State Commun. 149, 1 (2009)
L. Fang, F. Xiang, W. Liao, L. Liu, H. Zhang, X. Kuang, Mater. Chem. Phys. 143, 552 (2014)
R. Tang, C. Jiang, W. Qian, J. Jian, X. Zhang, H. Wang, H. Yang, Sci. Rep. 5, 13645 (2015)
A. K. Jonscher, Dielectric Relaxation in Solids (Dielectrics Press, 1999).
S. Thakur, R. Rai, I. Bdikin, M.A. Valente, Mater. Res. 19, 1 (2016)
R. Tang, C. Jiang, W. Qian, J. Jian, X. Zhang, H. Wang, H. Yang, Sci. Rep. Nat. Publ. Gr. 5:13645, 1 (2015).
C.G. Koops, Phys. Rev. 83, 121 (1951)
M.R. Díaz-Guillén, J.A. Díaz-Guillén, A.F. Fuentes, J. Santamaría, C. León, Phys. Rev. B Condens. Matter Mater. Phys. 82, 1 (2010)
L. Zhang, X. Ren, Phys. Rev. B 73, 94121 (2006)
G.D. Hu, S.H. Fan, C.H. Yang, W.B. Wu, Appl. Phys. Lett. 92, 192905 (2008)
J.P. Wright, J.P. Attfield, P.G. Radaelli, Phys. Rev. B 66, 214422 (2002)
N. Rezlescu, E. Rezlescu, Solid State Commun. 14, 69 (1974)
S. Chattopadhyay, P. Ayyub, V.R. Palkar, M. Multani, Phys. Rev. B 52, 13177 (1995)
L. He, D. Vanderbilt, Phys. Rev. B 68, 134103 (2003)
F. Xu, S. Trolier-McKinstry, W. Ren, B. Xu, Z.-L. Xie, K.J. Hemker, J. Appl. Phys. 89, 1336 (2001)
G. Viola, K. Boon Chong, F. Guiu, M. John Reece, J. Appl. Phys. 115, 34106 (2014)
Y. Tan, J. Zhang, Y. Wu, C. Wang, V. Koval, B. Shi, H. Ye, R. McKinnon, G. Viola, H. Yan, Sci. Rep. 5, 9953 (2015)
D. Damjanovic, Hysteresis in Piezoelectric and Ferroelectric Materials (Academic Press, 2006).
Q.M. Zhang, J. Zhao, K. Uchino, J. Zheng, J. Mater. Res. 12, 226 (1997)
S. Singh, O.P. Thakur, C. Prakash, J. Phys. D. Appl. Phys. 38, 1621 (2005)
J. Bao, J. Zhou, Z. Yue, L. Li, Z. Gui, J. Magn. Magn. Mater. 250, 131 (2002)
H. Zhang, J. Zhou, Y. Wang, L. Li, Z. Yue, Z. Gui, Mater. Lett. 55, 351 (2002)
S. Saha, T.P. Sinha, Phys. Rev. B 65, 134103 (2002)
J. Liu, C.G. Duan, W.G. Yin, W.N. Mei, R.W. Smith, J.R. Hardy, Phys. Rev. B Condens. Matter Mater. Phys. 70, 1 (2004)
Q. Ke, X. Lou, Y. Wang, J. Wang, Phys. Rev. B Condens. Matter Mater. Phys. 82, 1 (2010)
K. Verma, S. Sharma, Phys. Status Solidi Basic Res. 249, 209 (2012)
M. Belal Hossen, A.K.M. Akther Hossain, Adv. Mater. Lett. 6, 810 (2015)
A. Dutta, T.P. Sinha, S. Shannigrahi, Phys. Rev B 76, 155113 (2007)
N. Ortega, A. Kumar, P. Bhattacharya, S.B. Majumder, R.S. Katiyar, Phys. Rev. B 77, 014111 (2008)
R. Kumari, N. Ahlawat, A. Agarwal, S. Sanghi, M. Sindhu, N. Ahlawat, J. Magn. Magn. Mater. 414, 1 (2016)
R. Bergman, J. Appl. Phys. 88, 1356 (2000)
O. Raymond, R. Font, N. Suárez-Almodovar, J. Portelles, J. M. Siqueiros, J. Appl. Phys. 97, (2005).
T. Badapanda, V. Senthil, S.K. Rout, S. Panigrahi, T.P. Sinha, Mater. Chem. Phys. 133, 863 (2012)
L. Zhang and Z. J. Tang, Phys. Rev. B - Condens. Matter Mater. Phys. 70, 1 (2004).
B.H. Sohn, R.E. Cohen, G.C. Papaefthymiou, J. Magn. Magn. Mater. 182, 216 (1998)
M.M. Gallego, A.R. West, J. Appl. Phys. 90, 394 (2001)
A. K. Roy, A. Singh, K. Kumari, K. A. Nath, A. Prasad, and K. Prasad, Int. Sch. Reserach Netw. ISRN Ceram. 1 (2012).
K. Funke, Prog. Solid State Chem. 22, 111 (1993)
A.K. Behera, N.K. Mohanty, S.K. Satpathy, B. Behera, P. Nayak, Acta Metall. Sin. English Lett. 28, 847 (2015)
S. Sahoo, P.K. Mahapatra, R.N.P. Choudhary, M.L. Nandagoswami, A. Kumar, Mater. Res. Express 3, 065017 (2016)
J. Gebhardt, A.M. Rappe, Phys. Rev. B 98, 125202 (2018)
J. Dho, X. Qi, H. Kim, J.L. MacManus-Driscoll, M.G. Blamire, Adv. Mater. 18, 1445 (2006)
K. C. Kao, Dielectric Phenomena in Solids (2004).
V.R. Mastelaro, P.P. Neves, S.R. De Lazaro, E. Longo, A. Michalowicz, J.A. Eiras, J. Appl. Phys. 99, 44104 (2006)
N. Jiang, D. Su, J.C.H. Spence, Phys. Rev. B 76, 214117 (2007)
T. Xu, T. Shimada, Y. Araki, J. Wang, T. Kitamura, Nano Lett. 16, 454 (2016)
Acknowledgements
Authors are thankful to UGC-DAE Consortium for Scientific Research, Indore and IUAC New Delhi, India for providing research facilities. A. Kaur, gratefully acknowledges the University Grants Commission (UGC BSR) for her research fellowship and Dr. A. Das to Institute for Plasma Research (IPR) for providing post-doctoral fellowship. Authors D.S. and R.A. thanks Olle Engkvists Dtiftelse (198-0390), Carl Tryggers Stiftelse for Vetenskaplig Forskning (CTS: 18:4), and Swedish Research Council (VR-2016-06014) for financial support. SNIC and HPC2N are acknowledged for providing computing facilities.
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Kaur, A., Singh, D., Das, A. et al. Correlation between reduced dielectric loss and charge migration kinetics in NdFeO3-modified Ba0.7Sr0.3TiO3 ceramics. J Mater Sci: Mater Electron 32, 24910–24929 (2021). https://doi.org/10.1007/s10854-021-06949-5
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DOI: https://doi.org/10.1007/s10854-021-06949-5