Iranian Journal of Physics Research

Keywords = density-functional theory

Number of Articles: 4

Relativistic effects in the study of structure and electronic properties of UO2 within DFT+U method

Volume 23, Issue 3, Autumn 2023, Pages 141-146

https://doi.org/10.47176/ijpr.23.3.11777

Mahmoud Payami Shabestar, Samira Sheykhi

Comparison of SMC and OMC results in determining the ground-state and meta-stable states solutions for UO2 in the DFT+U method

Volume 23, Issue 3, Autumn 2023, Pages 189-195

https://doi.org/10.47176/ijpr.23.3.11820

Mahmoud Payami

Spin-symmetry broken ground-state of UO2 in DFT+U approach: the SMC method

Volume 22, Issue 3, Autumn 2022, Pages 175-184

https://doi.org/10.47176/ijpr.22.3.81568

Mahmoud Payami Shabestar

The study of the properties of point defects in pure-Zr and Zr-1%Nb alloy using density-functional theory and atomic simulation

Volume 20, Issue 1, Summer 2020, Pages 57-64

https://doi.org/10.47176/ijpr.20.1.38882

M Payami Shabestar, M R Basaadat

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