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RESEARCH PAPER · International Journal of Modern Physics B · 2013

FIRST-PRINCIPLES CALCULATION OF LEAD-FREE PEROVSKITE SnTiO 3

Hong-Jun Ye, Ruizhi Zhang, Dawei Wang, Yu Cui, JIE WEI, Chunlei Wang, Zhuo Xu, Shaobo Qu, Xiaoyong Wei

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FIRST-PRINCIPLES CALCULATION OF LEAD-FREE PEROVSKITE SnTiO 3OriginalAtomic layer deposition of environmentally benign SnTiOx as a potential ferroelectric material25Ferroelectric phase transition of perovskite SnTiO3 based on the first principles4DFT/PBE0 study on structural, electronic and dielectric properties of SnZr 0.50 Ti 0.50 O 3 lead-free ferroelectric material29Structure-Directing Lone Pairs: Synthesis and Structural Characterization of SnTiO336The first-principle study of mechanical, optical and thermoelectric properties of SnZrO3 and SnHfO3 for renewable energy applications79Tin titanate—the hunt for a new ferroelectric perovskite21Elastic, electronic and electrocaloric properties near room temperature in Mn -doped SnTiO3 from first-principles calculations6First Principles Study on Structural and Electronic Properties of Cubic (Pm3m) And Tetragonal (P4mm) ATiO3 (A=Pb, Sn)3Examination of possible high-pressure candidates of SnTiO3: The search for novel ferroelectric materials6Site occupancy of Li ions in Li-doped K(Ta1-xNbx)O3 single crystals: reanalysis of inelastic light scattering data and first-principles calculations2Brillouin Scattering Study of Electro-Optic KTa1−xNbxO3 Crystals9An atomistic modeling study of high-throughput RVO3(R=La, Nd) perovskites for efficient solar energy conversion materials10Pressure induced tuning of the physical properties of SnZrO3 and SnHfO3: A first principle study0Lead-free perovskites for next-generation applications: a comprehensive computational and data-driven review27

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  1. Atomic layer deposition of environmentally benign SnTiOx as a potential ferroelectric material

    Journal of Vacuum Science & Technology A Vacuum Surfaces and Films · 2015-11-12

    Siliang Chang, Sathees Kannan Selvaraj, Yoon-Young Choi, Seungbum Hong, Serge Nakhmanson, Christos G. Takoudis

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  2. Ferroelectric phase transition of perovskite SnTiO3 based on the first principles

    Acta Physica Sinica · 2016-01-01

    Hong-Jun Ye, Wang Dawei, Jiang Zhi-Jun, Cheng Sheng, Xiaoyong Wei

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  3. DFT/PBE0 study on structural, electronic and dielectric properties of SnZr 0.50 Ti 0.50 O 3 lead-free ferroelectric material

    Journal of Alloys and Compounds · 2017-04-26

    Renan Augusto Pontes Ribeiro, Sérgio Ricardo de Lázaro

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  4. Structure-Directing Lone Pairs: Synthesis and Structural Characterization of SnTiO3

    Chemistry of Materials · 2018-11-28

    Leo Diehl, Sebastian Bette, Florian Pielnhofer, Sophia B. Betzler, Igor L. Moudrakovski, Geoffrey A. Ozin, Robert E. Dinnebier, Bettina Valeska Lotsch

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  5. The first-principle study of mechanical, optical and thermoelectric properties of SnZrO3 and SnHfO3 for renewable energy applications

    Solid State Communications · 2019-01-21

    Qasim Mahmood, Bakhtiar Ul Haq, Muhammad Shahzad Yaseen, Shahid Mahmood Ramay, Muhammad Gul Bahar Ashiq, Asif Mahmood

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  6. Tin titanate—the hunt for a new ferroelectric perovskite

    Reports on Progress in Physics · 2019-08-01

    J Gardner, Atul Thakre, Ashok Kumar, J F Scott

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  7. Elastic, electronic and electrocaloric properties near room temperature in Mn -doped SnTiO3 from first-principles calculations

    Ceramics International · 2020-07-08

    Mustapha Tarnaoui, Noura Zaim, M. Kerouad, A. Zaim

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  8. First Principles Study on Structural and Electronic Properties of Cubic (Pm3m) And Tetragonal (P4mm) ATiO3 (A=Pb, Sn)

    Scientific Research Journal · 2020-08-25

    Nurakma Natasya Jahangir Alam, Nur Aisyah Ab Malik Marwan, Mohd Hazrie Samat, Muhammad Zamir Mohyedin, Nur Hafiz Hussin, Ab Malik Marwan Ali, Oskar Hasdinor Hassan, Muhd Zu Azhan Yahya, Mohamad Fariz Mohamad Taib

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  9. Examination of possible high-pressure candidates of SnTiO3: The search for novel ferroelectric materials

    APL Materials · 2021-02-01

    Florian Pielnhofer, Leo Diehl, Alberto Jiménez‐Solano, Annette Bussmann‐Holder, Johann Christian Schön, Bettina Valeska Lotsch

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  10. Site occupancy of Li ions in Li-doped K(Ta1-xNbx)O3 single crystals: reanalysis of inelastic light scattering data and first-principles calculations

    Ferroelectrics · 2022-01-02

    M. M. Rahaman, Seiji Kojima

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  11. Brillouin Scattering Study of Electro-Optic KTa1−xNbxO3 Crystals

    Materials · 2023-01-09

    M. M. Rahaman, Seiji Kojima

    Read original paper ↗ ·

  12. An atomistic modeling study of high-throughput RVO3(R=La, Nd) perovskites for efficient solar energy conversion materials

    Physica B Condensed Matter · 2023-04-13

    Md. Nadim Mahamud Nobin, Mithun Khan, Md. Lokman Ali

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  13. Pressure induced tuning of the physical properties of SnZrO3 and SnHfO3: A first principle study

    AIP Advances · 2023-07-01

    Md. Jaynal Abedin, Md. Sajib Hossain, M. Atikur Rahman, Ehsanul Azim, Md. Majibul Haque Babu, Md. Ibrahim Kholil, Alamgir Kabir

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  14. Lead-free perovskites for next-generation applications: a comprehensive computational and data-driven review

    Materials Advances · 2025-01-01

    Syeda Kinza Fatima, Reem H. Alzard, Riffat Amna, Mohammed H.H. Alzard, Kaibo Zheng, Mohamed A. Abdellah

    Read original paper ↗ ·
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