Temperature-induced structure instability and magnetism of FeÕCu„100..
نویسندگان
چکیده
The structure and magnetism of epitaxially grown Fe films on Cu~100! at 300 K have been investigated in situ using high energy electron diffraction, low energy electron diffraction, scanning tunneling microscopy, and the magneto-optical Kerr effect. Based on a careful thickness calibration, the three well-known regions with distinct magnetic properties are determined accurately for Fe films on Cu~100!. We claim that the traditional region II should be further divided into two parts II~1! and II~2!, where the former remains region II in the traditional sense but the latter is a transition region between regions II and III. A theoretically predicted temperature driven Martensitic phase transition from face-centered-cubic ~fcc! Fe to body-centered-cubic Fe is indeed realized in the transition region II~2!.
منابع مشابه
Density Functional Studies on Crystal Structure and electronic properties of Potassium Alanate as a candidate for Hydrogen storage
Potassium Alanate is one of the goal candidates for hydrogen storage during past decades. In this report, initially the Density Functional Theory was applied to simulate the electronic and structural characteristic of the experimentally known KAlH4 complex hydride. The relaxation of unit cell parameters and atomic positions was performed until the total residual force reduced less than 0.001ev ...
متن کاملDensity-functional calculations of the electronic structures and magnetism of the pnictide superconductors BaFeAs2 and BaFeSb2
We investigate the structural, electronic, and magnetic properties of the hypothetical compound BaFePn2 Pn=As and Sb , which is isostructural to the parent compound of the high-temperature superconductor LaFeAsO1−xFx. Using density-functional theory, we show that the Fermi surface, electronic structure, and spin-density wave instability of BaFePn2 are very similar to the Fe-based superconductor...
متن کاملUnexpected origin of magnetism in monoclinic Nb12O29 from first-principles calculations
Nb12O29 is a 4d transition metal oxide that occurs in two forms with different symmetries, monoclinic (m) and orthorhombic (o). The monoclinic form has unusual magnetic properties; below a temperature of 12 K, it exhibits both metallic conductivity and antiferromagnetic ordering. Here, first-principles densityfunctional theory calculations are used to study the structure, relative stability and...
متن کاملThermodynamics of the interplay between magnetism and high-temperature superconductivity.
Copper-oxide-based high-temperature superconductors have complex phase diagrams with multiple ordered phases. It even appears that the highest superconducting transition temperatures for certain cuprates are found in samples that display simultaneous onset of magnetism and superconductivity. We show here how the thermodynamics of fluid mixtures-a touchstone for chemistry as well as hard and sof...
متن کاملInvestigation and Modification of the Magnetism of Epitaxial Fe Structures
In this thesis, the magnetic and structural properties of layered epitaxial film systems and clusters are presented. A main achievement is the investigation of the direct correlation between magnetism and structural or morphological details of ultrathin films. For this purpose, the film structure has been accessed directly by means of surface science methods. The effect of structural changes on...
متن کامل