arXiv subjects

J. S. Amaral

Publications and source records attributed to J. S. Amaral.

7 recordsLinked to original sources

arXiv2026

Finite-temperature micromagnetic model bridging atomic- and macro-scale magnetism

A multi-scale finite-temperature micromagnetic model is presented, based on the Landau-Lifshitz equation and the Bernoulli differential equation. This model accurately reproduces classic Maxwell magnetostatics of paramagnets for high temperatures and accurately reproduces standard micromagnetics described by the conventional Landau-Lifshitz model in ferromagnets. The Landau-Lifshitz-Bernoulli (LLBe) model can, by design, directly couple atomic-scale simulations with micromagnetics and output consistent predictions of bulk magnetic properties at finite temperatures, from below to above the material's Curie temperature. The LLBe model is validated against established solvers: MUMAX3 for zero-temperature micromagnetics, and FEMCE for high-temperature classic magnetostatics. We present an application of the LLBe model by simulating Heat-Assisted magnetic recording on a thin magnetic track with local heating, demonstrating the multi-scale finite-temperature capabilities of the LLBe.

cond-mat.mtrl-sci↗

arXiv2025

Quantum caloric effects

Quantum thermodynamics aims to explore quantum features to enhance energy conversion beyond classical limits. While significant progress has been made, the understanding of caloric potentials in quantum systems remains incomplete. In this context, this study focuses on deriving general expressions for these caloric potentials, by developing a quantum Maxwell relationship obtained from a thermal average form of the Ehrenfest theorem. Our results recover the classical cases and also reveal that the isothermal entropy change can be related to genuine quantum correlations in the system. Thus, this work aims to contribute to the understanding of the caloric behavior of quantum systems and their potential implication in caloric devices.

quant-ph↗

arXiv2024

On correctly assessing the reversibility of the magnetocaloric effect from indirect measurements

The adiabatic temperature change ($ΔT_{ad}$) of a magnetic refrigerant can be indirectly estimated through field ($H$) and temperature ($T$) dependent magnetization ($M$) and specific heat ($C_p$) measurements. A direct integration approach for this estimation is frequently reported, which is an approximation to a rigorous mathematical approach. In this work, we propose an iterative method in small $H$ steps, to estimate $ΔT_{ad}$ from indirect measurements. We show that this approach is able to reproduce the reversibility of the magnetocaloric effect, and provides a more accurate estimation of $ΔT_{ad}$, up to 10\% when considering a detailed $M(H,T)$ and $Cp(H,T)$ dataset that reproduces the magnetothermal properties of gadolinium, a benchmark room-temperature magnetic refrigerant.

cond-mat.mtrl-sci↗

arXiv2022

Accurate Estimate of the Joint Density of States via Flat Scan Sampling

A Monte Carlo method to estimate the Joint Density of States g(E,M) of the Ising and Ising-like models is presented. The method is applied to the well-known 2D Ising model, and is shown to be accurate, efficient, and embarrassingly parallel. The method presented offers major improvements over existing approaches. Furthermore, we obtain g(E,M) estimates for the spin S Ising model, with the spin number S = {1/2, 1, 3/2, 2}, thus showing that the algorithm can handle larger and more complex (E, M) phase spaces.

cond-mat.stat-mech↗

arXiv2020

A geometry-independent moment correction method for the Magnetic Property Measurement 3 Superconducting Quantum Interference Device-Vibrating Sample Magnetometer

The sensitivity and automation capabilities of modern superconducting quantum interference device (SQUID) magnetometers are currently unmatched. The measured moment values are, however, prone to deviations from their actual value due to geometric effects, namely sample size, shape, and radial offset. This is well known, and a knowledgeable operator will correct measured moment values taking these effects into account. The current procedure for the Magnetic Property Measurement 3 (MPMS3) magnetometer is based on an available simulation tool, valid for both Vibrating Sample Magnetometer (VSM) and Direct Current (DC) methods. Still, determining the correction factor requires samples with well-defined geometric shapes together with accurate sample dimensions and the usually difficult to determine radial offset. Additionally, at the moment, there is not a proper solution to correct geometry effects of irregular shaped samples. In this work, we find a systematic relation between the difference between the VSM and DC measurements and their corresponding correction factors for MPMS3 SQUID-VSM device. This relation follows a clear trend, independent of sample size, shape or radial offset, for a given pair of DC scan length and VSM amplitude values. Exploiting this trend, a geometry-independent correction method is here presented and validated by measurements of metallic Fe powder using a far from optimal sample mounting.

physics.app-ph↗

arXiv2016

Magnetovolume Effects in Heusler Compounds via First-Principles Calculations

Heusler alloys are promising for several applications, including magnetic refrigeration, due to high magnetocaloric and magnetovolume effects. One way to optimize this potential is by increasing the magnetovolume effect. Using density functional theory with the Korringa-Kohn-Rostoker method, we calculate the effective exchange interaction energies and corresponding mean field Curie temperature as a function of the volume (hydrostatic pressure) in several L2 1 -type Co 2 YZ Heusler alloys. Different qualitative trends and signs of the pressure derivatives of the Curie temperature and moments are found among these compounds, discussed and compared with previous calculations and experiments.

cond-mat.mtrl-sci↗

arXiv2016

Volume dependence of magnetic properties in Co2Cr1-xYxGa (Y=Ti-Ni) Heusler alloys: a first-principles study

The magnetic properties tuning and volume dependence in the series of quaternary full Heusler alloys with formula Co2Cr1-xYGa (Y = Ti, V, Mn, Fe, Co, Ni) were studied with a detailed first-principles exploration. We employ the density functional KKR method with the coherent potential approximation, estimating effective Heisenberg exchange constants via the magnetic force theorem together with mean-field Curie temperature (TC) and magnetic moment for compositions in the whole concentration range. The volumetric dependency of these magnetic properties is studied, particularly the pressure derivatives of TC at equilibrium. Our ternary alloy calculations show good agreement with local-density and generalized gradient approximations in the literature. The quaternary alloys show a wide range of tunable magnetic properties, where magnetic moments range from 0.8 to 4.9 mu_B, TC from 130 K to 1250 K, and dTC/dV values range from -7 to +6.3 K A-3.

cond-mat.mtrl-sci↗