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Ish: DFT-Mbj Study of Electronic and Magnetic Properties of Cubic Cecro3 Compound: An Ab-Initio Investigation

1. Electronic, magnetic, and thermodynamic properties of orthorhombic <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" altimg="si1.svg"> <mml:mrow> <mml:msub> <mml:mrow> <mml:mi>C</mml:mi> <mml:mi>e</mml:mi> <mml:mi>S</mml:mi> <mml:mi>c</mml:mi> <mml:mi>O</mml:mi> </mml:mrow> <mml:mn>3</mml:mn> </mml:msub> </mml:mrow> </mml:math> , <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" altimg="si2.svg"> <mml:mrow> <mml:msub> <mml:mrow> <mml:mi>C</mml:mi> <mml:mi>e</mml:mi> <mml:mi>T</mml:mi> <mml:mi>i</mml:mi> <mml:mi>O</mml:mi> </mml:mrow> <mml:mn>3</mml:mn> </mml:msub> </mml:mrow> </mml:math> , and <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" altimg="si3.svg"> <mml:mrow> <mml:msub> <mml:mrow> <mml:mi>C</mml:mi> <mml:mi>e</mml:mi> <mml:mi>V</mml:mi> <mml:mi>O</mml:mi> </mml:mrow> <mml:mn>3</mml:mn> </mml:msub> </mml:mrow> </mml:math> using GGA and GGA+U

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2. Ab initio insights into the physical properties of cubic CeFeO3 perovskite

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