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Mn-doped \b{eta}-Ga2O3 (GMO) films with room-temperature ferromagnetism (RTFM) are synthesized by polymer-assisted deposition and the effects of annealing atmosphere (air or pure O2 gas) on their structures and physical properties are…

Materials Science · Physics 2022-05-10 Xu Dai , Xi Zhang , Gang Xiang

The modification of the properties of CeO$_2$ through aliovalent doping are investigated within the \emph{ab-initio} density functional theory framework. Lattice parameters, dopant atomic radii, bulk moduli and thermal expansion…

It has been demonstrated in previous experimental and computational work that doping CeO2 with transition metals is an effective way of tuning its properties. However, each previous study on CeO2 doping has been limited to a single or a few…

Materials Science · Physics 2020-12-14 Zhao Liua , Hongyang Ma , Charles C. Sorrell , Pramod Koshy , Judy N. Hart

We have explored, computationally and experimentally, the magnetic properties of \fecob{} alloys. Calculations provide a good agreement with experiment in terms of the saturation magnetization and the magnetocrystalline anisotropy energy…

Resistivity and dc magnetization measurements were performed for the polycrystalline Pr$_{0.5}$Ca$_{0.5}$Co$_{1-x}$Fe$_{x}$O$_{3-\delta}$ ($x$ = 0, 0.05, 0.10 and 0.15) samples. The as-fabricated samples exhibit ferromagnetic (FM)…

Strongly Correlated Electrons · Physics 2009-11-11 X. G. Luo , X. Li , G. Y. Wang , G. Wu , X. H. Chen

TiO$_2$ anatase doped with Co has been recently reported to exhibit room-temperature ferromagnetism. $Ab$ $initio$ study on substitutional Co doping, however, yielded much larger magnetic moment for Co than experiment. Our calculations…

Materials Science · Physics 2007-05-23 W. T. Geng , K. S. Kim

The properties of the MoSr2YCu2O8 materials are found to systematically change with the oxygen concentration determined by the sintering and annealing conditions. The as-prepared (asp) sample is anti-ferromagnetically (AFM) ordered at 16 K.…

Superconductivity · Physics 2009-11-10 I. Felner , E. Galstyan

We report a first-principles study on the geometric, electronic and magnetic properties of V-doped anatase TiO$_{2}$. The DFT+U (Hubbard coefficient) approach predicts semiconductor band structures for Ti$_{1-x}$V$_{x}$O$_{2}$ (x=6.25 and…

Materials Science · Physics 2007-05-23 Xiaosong Du , Qunxiang Li , Haibin Su , Jinlong Yang

DyMn$_2$O$_5$ is an intriguing multiferroic material showing multiple magnetic, electric and structural transitions. We present here the systematic study on the effect of Sr doping at the Dy site of DyMn$_2$O$_5$ through magnetic and…

Strongly Correlated Electrons · Physics 2020-04-22 P. Dutta , M. Das , S. Mukherjee , S. Chatterjee , S. Giri , S. Majumdar

This letter reports on the magnetic properties of Ti1-xCoxO2 anatase phase nanopowders with different Co contents. It is shown that oxygen vacancies play a fundamental role in promoting the long-range ferromagnetic order in the material…

Materials Science · Physics 2009-05-01 L. C. J. Pereira , M. R. Nunes , O. C. Monteiro , A. J. Silvestre

We investigate the magnetic and transport properties of the $La_{1-x}Sr_{x}MnO_{3}$ (LSMO)/$Pr_{1-x}Ca_{x}MnO_{3}$ (PCMO) like ferromagnetic/antiferromagnetic superlattices in three dimensions using a two orbitals double exchange model…

Strongly Correlated Electrons · Physics 2024-06-03 Sandip Halder , Snehal Mandal , Kalpataru Pradhan

Using Density Functional Theory (DFT) calculations and Monte-Carlo (MC) simulations, we investigate the recently reported magnetic transition in B2 Al-Cr-Co alloys. The Cr sublattice is alloyed with different amounts of Co in the…

Effects of Al, Mn and Sb dopings in CeFe2 and effect of applied pressure have been investigated. Al doping gives rise to the FM-AFM transition and a reduction in the magnetic moment and TC values, clearly indicating the growth of the AFM…

Strongly Correlated Electrons · Physics 2010-05-21 Arabinda Haldar , K. G. Suresh , A. K. Nigam , A. A. Coelho , S. Gama

Oxide based diluted magnetic semiconductor (DMS) materials have been a subject of increasing interest due to reports of room temperature ferromagnetism in several systems and their potential use in the development of spintronic devices.…

Materials Science · Physics 2012-12-06 A. J. Silvestre , L. C. J. Pereira , M. R. Nunes , O. C. Monteiro

Electron- and hole-doped La$_2$CoMnO$_6$(LCMO) are investigated using first principles DFT calculations. Hole and electron doping are achieved respectively by introducing Sr$^{2+}$ at La$^{3+}$ sites and by inducing O-site vacancies in…

Materials Science · Physics 2021-09-02 Anasua Khan , Swastika Chatterjee , T. K. Nath , A. Taraphder

We present molecular dynamics simulations of shallow Al implantation in 4H-SiC to clarify how implantation temperature and dose control defect evolution and dopant activation during early annealing. Using the Gao-Weber potential together…

Materials Science · Physics 2026-04-27 Sabine Leroch , Robert Stella , Andreas Hössinger , Lado Filipovic

The Co-doped anatase TiO$_{2}$, a recently discovered room-temperature ferromagnetic insulator, has been studied by the first-principles calculations in the pseudo-potential plane-wave formalism within the local-spin-density approximation…

Materials Science · Physics 2007-05-23 Hongming Weng , Xiaoping Yang , Jinming Dong , H. Mizuseki , M. Kawasaki , Y. Kawazoe

Tailoring the magnetic properties of iron oxide nanosystems is essential to expand their biomedical applications. In this study, the 34 nm iron oxide nanocubes with two phases consisting of Fe3O4 and alpha-Fe2O3 were annealed for 2 hours in…

Materials Science · Physics 2024-02-01 Supun B. Attanayake , Amit Chanda , Raja Das , Manh-Huong Phan , Hariharan Srikanth

Low temperature magnetic properties of Cd-doped Ce2MIn8 (M = Rh and Ir) single crystals are investigated. Experiments of temperature dependent magnetic susceptibility, heat capacity and electrical resistivity measurements revealed that…

Strongly Correlated Electrons · Physics 2014-07-10 C. Adriano , C. Giles , E. M. Bittar , L. N. Coelho , F. de Bergevin , C. Mazzoli , L. Paolasini , W. Ratcliff , R. Bindel , J. W. Lynn , Z. Fisk , P. G. Pagliuso

Density functional theory (DFT) and DFT corrected for on-site Coulomb interactions (DFT+U) calculations are presented on Aluminium doping in bulk TiO$_2$ and the anatase (101) surface. Particular attention is paid to the mobility of oxygen…

Materials Science · Physics 2014-03-24 Conn O'Rourke , David R. Bowler
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