17–22 May 2026
C.I.D
Europe/Zurich timezone

Experimental and First-Principles GGA-PBE Insights into SHI-Induced Defects and Local Bonding Among Different Grain Sizes in Ce₀.₇₅Gd₀.₂₅O₂

SUP8605
17 May 2026, 14:00
4h
C.I.D

C.I.D

Poster Presentation MC8.U08: Radiation Effects Student poster session

Speaker

VIVEK KUMAR (Jawaharlal Nehru University)

Description

To evaluate radiation tolerance, 25 mol% Gd₂O₃-doped CeO₂ nano powders were synthesized by a sol-gel combustion route and sintered at 800°C, 1000°C, and 1300°C to obtain different grain sizes. The pellets were irradiated with 100 MeV iodine ions to simulate fission-fragment damage, and structural and electronic changes were examined using synchrotron GIXRD, Raman spectroscopy, EXAFS, XPS, and electron microscopy. Smaller grain-sized samples (800°C) exhibited more significant irradiation-induced degradation compared to larger grain-sized samples (1300°C), although both maintained their fluorite cubic structure at the highest ion fluence (1×10¹⁴ ions/cm²). EXAFS indicated Ce–O bond relaxation, Gd-coordination changes, and redistribution of oxygen vacancies. Raman peak broadening suggested vacancy-related defect complexes, and XPS revealed shifts in Ce³⁺/Ce⁴⁺ ratios and charge redistribution. First-principles GGA-PBE calculations support vacancy stabilization and local bonding rearrangement. The results highlight clear grain-size-dependent radiation response in Gd-doped CeO₂ and its relevance for nuclear and space applications.

Footnotes

  1. Supported by UGC fellowship and experimental facilities at JNU, IUAC, RRCAT, and BARC.
  2. GANIL proposal acceptance indicates future extension of this work.
In which format do you inted to submit your paper? Word

Author

VIVEK KUMAR (Jawaharlal Nehru University)

Co-authors

Prof. Vinita Grover (Bhabha Atomic Research Centre) Prof. Pawan Kumar Kulriya (Jawaharlal Nehru University)

Presentation materials

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