CALPHAD modeling based on Gibbs energy functions from zero kevin and improved magnetic model: a case study on the Cr–Ni system
The third-generation thermodynamic database that adopts the physics-based models over a
wide temperature range is being developed in an attempt to increase the predictability and …
wide temperature range is being developed in an attempt to increase the predictability and …
First-principles calculations of phonon and thermodynamic properties of Fe-Si compounds
The phonon approach and the Debye model are combined to predict the vibrational
thermodynamic contribution for the following Fe-Si compounds: Fe3Si, Fe2Si, Fe5Si3, FeSi …
thermodynamic contribution for the following Fe-Si compounds: Fe3Si, Fe2Si, Fe5Si3, FeSi …
Phase-decomposition-related short-range ordering in an Fe–Cr alloy
SM Dubiel, J Żukrowski - Acta materialia, 2013 - Elsevier
A redistribution of Cr atoms related to a phase decomposition (PD) caused by an isothermal
annealing at 415° C in a 15.15 at.% Cr Fe–Cr alloy was studied in an ex situ way by the …
annealing at 415° C in a 15.15 at.% Cr Fe–Cr alloy was studied in an ex situ way by the …
Theoretical elastic moduli of ferromagnetic bcc Fe alloys
H Zhang, MPJ Punkkinen, B Johansson… - Journal of Physics …, 2010 - iopscience.iop.org
The polycrystalline elastic parameters of ferromagnetic Fe 1− x M x (M= Al, Si, V, Cr, Mn, Co,
Ni, Rh; 0≤ x≤ 0.1) random alloys in the body centered cubic (bcc) crystallographic phase …
Ni, Rh; 0≤ x≤ 0.1) random alloys in the body centered cubic (bcc) crystallographic phase …
Elastic anomalies in Fe–Cr alloys
H Zhang, G Wang, MPJ Punkkinen… - Journal of Physics …, 2013 - iopscience.iop.org
Using ab initio alloy theory, we determine the elastic parameters of ferromagnetic and
paramagnetic Fe 1− c Cr c (0≤ c≤ 1) alloys in the body centered cubic crystallographic …
paramagnetic Fe 1− c Cr c (0≤ c≤ 1) alloys in the body centered cubic crystallographic …
Influence of Cr-content on the local atomic structure of Fe–Cr alloy, a study using EXAFS
High Cr ferritic/martensitic steels are considered one of the most promising structural
materials for advanced nuclear power plants. Therefore, understanding properties' evolution …
materials for advanced nuclear power plants. Therefore, understanding properties' evolution …
Enhancing the possibilities of 57Fe Mössbauer spectrometry to the study of chemical and physical properties of iron in medicines
Abstract 57 Fe Mössbauer spectrometry (MS) has long been used to study medicines that
contain organic and inorganic iron-based compounds. The technique contributes to identify …
contain organic and inorganic iron-based compounds. The technique contributes to identify …
Surface Debye temperature determination from LEED: correlation to defects in epitaxial films
MC Adam, N Darukhanawalla, JM Gaudet, G O'Hara… - Surface Science, 2022 - Elsevier
Low energy electron diffraction (LEED) peak intensities were measured to estimate surface
Debye temperature for epitaxially-grown silicon thin films and for bulk Si (001). Rutherford …
Debye temperature for epitaxially-grown silicon thin films and for bulk Si (001). Rutherford …
Study of phase stability in the σ-FeCr system
Formation energy of the σ-phase in the Fe-Cr alloy system, ΔE, was computed versus the
occupancy changes on each of the five possible lattice sites. Its dependence on a number of …
occupancy changes on each of the five possible lattice sites. Its dependence on a number of …
X-ray study of Debye temperatures of bcc–Fe–Cr mechanical alloys
L Jithender, N Gopikrishna - Indian Journal of Physics, 2013 - Springer
The mean square amplitudes of vibration, Debye–Waller factors and Debye temperatures of
bcc Fe 100–x Cr x alloys prepared by mechanical alloying have been obtained from X-ray …
bcc Fe 100–x Cr x alloys prepared by mechanical alloying have been obtained from X-ray …