Investigation of the transport, structural and mechanical properties of half-metallic REMnO 3 (RE= Ce and Pr) ferromagnets
Systematic investigation of the ground state structure, which includes elastic and transport
properties, of perovskite oxides REMnO3 (RE= Ce and Pr) has been carried out by first …
properties, of perovskite oxides REMnO3 (RE= Ce and Pr) has been carried out by first …
Electronic structure and magnetic properties of the perovskites srtmo3 (tm= mn, fe, co, tc, ru, rh, re, os and ir)
Structural, elastic, electronic and magnetic properties of the transition metals based
perovskites SrTMO 3 (TM= Mn, Fe, Co, Tc, Ru, Rh, Re, Os, Ir) are investigated using …
perovskites SrTMO 3 (TM= Mn, Fe, Co, Tc, Ru, Rh, Re, Os, Ir) are investigated using …
Half-metallic ferromagnetism in PrMnO3 perovskite from first principles calculations
The structural, electronic and magnetic properties of the cubic praseodymium oxides
perovskites PrMnO 3 were calculated using the density functional theory (DFT) with both …
perovskites PrMnO 3 were calculated using the density functional theory (DFT) with both …
Opto-electronic, magnetic, thermodynamic and thermoelectric properties of cubic perovskite SrMnO3: a first principle based spin polarized calculation
Density functional theory (DFT) calculations have been made on cubic perovskite
compound, SrMnO 3 to investigate electronic, magnetic, optical and thermodynamic …
compound, SrMnO 3 to investigate electronic, magnetic, optical and thermodynamic …
Electronic structure and magnetic properties of the perovskite cerium manganese oxide from ab initio calculations
We have performed first-principle calculations of the structural, electronic and magnetic
properties of cerium manganese oxide (CeMnO) 3, using full-potential linearized augmented …
properties of cerium manganese oxide (CeMnO) 3, using full-potential linearized augmented …
Thermoelectric and phononic properties of (Gd, Tb) MnO3 compounds: DFT calculations
HAR Aliabad, Z Barzanuni, SR Sani, I Ahmad… - Journal of Alloys and …, 2017 - Elsevier
We have investigated the structural, electronic, magnetic, phononic and thermoelectric
properties of rare earth multiferroic manganite RMnO 3 (R= Gd and Tb) compounds by the …
properties of rare earth multiferroic manganite RMnO 3 (R= Gd and Tb) compounds by the …
Perovskite-structure TlBO 3 (B= Cr, Mn) for thermomechanical and optoelectronic applications: an investigation via a DFT scheme
W Hasan, AM Hossain, M Rasheduzzaman… - RSC …, 2022 - pubs.rsc.org
First-principles-based DFT calculations have been carried out to analyze the structural,
mechanical, elastic anisotropic, Vickers hardness, electronic, optical, and thermodynamic …
mechanical, elastic anisotropic, Vickers hardness, electronic, optical, and thermodynamic …
Structural, thermal, elastic, electronic and magnetic properties of cubic lanthanide based perovskites type oxides PrXO3 (X = V, Cr, Mn, Fe): insights from ab initio …
M El Amine Monir, FZ Dahou - SN Applied Sciences, 2020 - Springer
Different properties such as the structural, elastic, thermal, electronic, magnetic as well as
the Curie temperature and the formation energy of the cubic perovskites PrXO 3 compounds …
the Curie temperature and the formation energy of the cubic perovskites PrXO 3 compounds …
Consequences of Tuning Rare-Earth RE3+-Site and Exchange–Correlation Energy U on the Optoelectronic, Mechanical, and Thermoelectronic Properties of Cubic Manganite …
MM Saad H.-E, BO Alsobhi - ACS omega, 2022 - ACS Publications
Both rare-earth SmMnO3 and EuMnO3 compounds that belong to transition-metal-based
manganite perovskites REMnO3 have been studied deeply in this paper. The structural …
manganite perovskites REMnO3 have been studied deeply in this paper. The structural …
Insight into electronic structure, magnetic, mechanical and thermodynamic properties of double perovskite Ba2MgReO6: A first-principles investigation
SA Dar, V Srivastava, UK Sakalle, G Pagare - Computational Condensed …, 2018 - Elsevier
In the present paper, we have investigated structural, electronic, magnetic, mechanical and
thermodynamic properties of cubic double perovskite oxide Ba 2 MgReO 6 within density …
thermodynamic properties of cubic double perovskite oxide Ba 2 MgReO 6 within density …