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First-order magnetostructural phase transitions underpin giant magnetocaloric effects, yet the microscopic role of lattice dynamics in these transitions remains controversial. Here we use first-principles spin-lattice dynamics simulations…

Materials Science · Physics 2026-01-12 Lokanath Patra , Zeyu Xiang , Yubi Chen , Bolin Liao

The search for energy-efficient and environmentally friendly cooling technologies is a key driver for the development of magnetic refrigeration based on the magnetocaloric effect (MCE). This phenomenon arises from the interplay between…

Designing the high performance magneto or elastocaloric effect in NiMnIn alloys with spin-lattice coupling in a deep freezing temperature range of 200 K to 255 K is challenging due to the limited lattice entropy change and large negative…

The magnetocaloric effect (MCE) in paramagnetic materials has been widely used for attaining very low temperatures by applying a magnetic field isothermally and removing it adiabatically. The effect can be exploited also for room…

By combination of two independent approaches, nuclear resonant inelastic X-ray scattering and first-principles calculations in the framework of density functional theory, we determine the element-resolved vibrational density of states in…

The efficient coupling between lattice degrees of freedom and spin degrees of freedom in magnetic materials can be used for refrigeration and energy conversion. This coupling is enhanced in materials exhibiting the giant magnetocaloric…

Neutron scattering and ultrasonic methods have been used to study the lattice dynamics of two single crystals of Ni-Mn-In Heusler alloys close to Ni$_{50}$Mn$_{34}$In$_{16}$ magnetic superelastic composition. The paper reports the…

In the fundamental understanding of magnetic interactions between atoms in solids, the crystal lattice is one of the key parameters. As the effective tool for controlling the lattice using tensile stress is limited, there are only few…

La-Fe-Si-based alloys are among the most application-ready magnetocaloric materials for room-temperature magnetic refrigeration. Powder metallurgy methods have been previously demonstrated to successfully produce structures with sub-mm…

We report on measurements of the adiabatic temperature change in the inverse magnetocaloric Ni$_{50}$Mn$_{34}$In$_{16}$ alloy. It is shown that this alloy heats up with the application of a magnetic field around the Curie point due to the…

Sigma-phase Fe0.525Cr0.455Ni0.020 alloy was studied by means of M\"ossbauer spectrometry in the temperature range of 5-293 K. The average center shift, <CS>, determined from the recorded M\"ossbauer spectra was shown to significantly…

Strongly Correlated Electrons · Physics 2022-03-04 Stanisław M. Dubiel , Jan Żukrowski

Alternating (AC) magnetic fields can induce not only an alternating magnetization in materials, but also an alternating temperature via the magnetocaloric effect. The latter effect is typically neglected when performing AC susceptibility…

Materials Science · Physics 2026-03-16 Yuntian Li , Jiayi Hu , Dominic Petruzzi , Linda Ye , Mark P. Zic , Arkady Shekhter , Ian R. Fisher

The magnetic and magnetocaloric properties of polycrystalline La0.70(Ca0.30-xSrx)MnO3:Ag 10% manganite have been investigated. All the compositions are crystallized in single phase orthorhombic Pbnm space group. Both, the Insulator-Metal…

Strongly Correlated Electrons · Physics 2015-06-05 R. Jha , Shiva Kumar Singh , Anuj Kumar , V. P. S. Awana

Using a first-principles fully relativistic scheme based on ultrasoft pseudopotentials and density functional perturbation theory, we study the magnetocrystalline anisotropy free energy of the ferromagnetic binary compound MnBi. We find…

Materials Science · Physics 2021-03-26 Andrea Urru , Andrea Dal Corso

The non-stoichiometric Heusler alloy Ni$_{50}$Mn$_{36}$In$_{14}$ undergoes a martensitic phase transformation in the vicinity of 345 K, with the high temperature austenite phase exhibiting paramagnetic rather than ferromagnetic behavior, as…

Materials Science · Physics 2015-06-30 Jing-Han Chen , Nickolaus M. Bruno , Ibrahim Karaman , Yujin Huang , Jianguo Li , Joseph H. Ross

Using a combination of first-principles and magnetization-dynamics calculations, we study the effect of the intense optical excitation of phonons on the magnetic behavior in insulating magnetic materials. Taking the prototypical…

Strongly Correlated Electrons · Physics 2018-06-13 M. Fechner , A. Sukhov , L. Chotorlishvili , C. Kenel , J. Berakdar , N. A. Spaldin

The structural and magnetic properties of Mn5Ge3Cx films prepared at elevated substrate temperatures TS are investigated. In particular, films with x >= 0.5 and TS = 680 K exhibit a strongly enhanced Curie temperature TC = 440 K compared to…

Materials Science · Physics 2009-10-31 M. Gajdzik , C. Suergers , M. Kelemen , H. v. Loehneysen

Off-stoichiometric Ni$_2$MnIn Heusler alloys have drawn recent attention due to their large magnetocaloric entropy change associated with the first-order magneto-structural transition. Here we present crystal structural, calorimetric and…

In semiconductors almost all heat is conducted by phonons (lattice vibrations), which is limited by their quasi-particle lifetimes. Phonon-phonon interactions represent scattering mechanisms that produce thermal resistance. In…

We study the lattice dynamics effects on the phase stability and magnetocrystalline anisotropy (MCA) energy of CaCu$_5$-type YCo$_5$ at finite temperatures using first-principles calculations based on density functional theory (DFT).…

Materials Science · Physics 2022-04-06 Guangzong Xing , Yoshio Miura , Terumasa Tadano
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