Condensed matter physics and materials science form a dynamic partnership, exploring how the collective behavior of atoms gives rise to the unique properties of solids and liquids. This field bridges the gap between fundamental quantum mechanics and the practical engineering of everything from flexible electronics to superconductors, turning abstract theories into tangible innovations that shape our daily lives.

At Gist.Science, we process every new preprint in this category directly from arXiv to make these complex discoveries accessible to everyone. Our team generates both plain-language overviews and detailed technical summaries for each paper, ensuring that researchers, students, and curious minds alike can grasp the latest breakthroughs without getting lost in dense jargon.

Below are the latest papers in condensed matter and materials science, organized by their most recent publication dates.

🔬 materials science

First-principles calculations of the thermodynamic factor of multicomponent alloys

This paper introduces two efficient computational routes to calculate the thermodynamic factor for non-dilute diffusion in multicomponent alloys by accounting for vacancy-mediated free energy curvature, thereby enabling accurate and resource-efficient predictions of diffusion matrices for use in mesoscale mass transport simulations.

Damien K. J. Lee, Shashank Saxena, Anton Van der Ven, Anirudh Raju Natarajan2026-09-28
🔬 materials science

Polar discontinuity screening by charge disproportionation in ferroelectric-nickelate superlattices

Using density functional theory, this study demonstrates that charge disproportionation in SmNiO3_3 serves as a novel mechanism to screen polar discontinuities at interfaces with ferroelectric BaTiO3_3 by redistributing electrons and altering the nickel oxidation states to compensate for interface charges.

Edith Simmen, Jonathan Amara, Philippe Ghosez, Nicola A. Spaldin2026-09-28
🔬 materials science

Dielectric response of the antiferromagnetic multiferroics with cycloidal equilibrium for the polarization related to the noncollinear spins

This paper analytically investigates the linear dielectric response of antiferromagnetic multiferroics with cycloidal equilibrium and weak ferromagnetism, deriving the dynamical electric susceptibility tensor to demonstrate how noncollinear spin-induced polarization, low-frequency gapless spin waves, and the spiral structure influence the system's reaction to alternating electric fields.

Pavel A. Andreev2026-09-28
🔬 materials science

Ferroelectric Switching in ZnO/Zn1-xMgxO Heterostructures: Atomistic Insights into Interfacial Coupling and Layer Architecture

This study utilizes ReaxFF molecular dynamics and experimental validation to demonstrate that layer topology and interfacial mechanical confinement are critical design variables for optimizing ferroelectric switching in ZnO/Zn1-xMgxO heterostructures, revealing that specific architectural arrangements can significantly reduce the required switching field through stress-assisted cooperative pathways.

Alireza Sepehrinezhad, Ali Mohammadi Dinani, Ece Gunay, Elizabeth C. Dickey, Jon-Paul Maria, Susan Trolier-McKinstry, Ad (…)2026-09-28
🔬 materials science

Scaling Density Functional Theory with Gaussian Splatting

This paper introduces Gaussian Splatting for Density Functional Theory (GS-DFT), a novel method that represents molecular orbitals as an optimized cloud of Gaussians to achieve high accuracy with significantly fewer parameters and quadratic memory scaling, enabling the simulation of large systems up to 2,742 atoms on a single four-GPU node.

Andrés Guzmán-Cordero, Cindy Zhang, Majdi Hassan, Marta Skreta, Kirill Neklyudov, Matija Medvidović2026-09-28
🔬 materials science

Crystallographic-orientation dependence of the early-stage oxidation of Zr single crystals: an XPS study of suboxide formation and in-depth distribution

This XPS study reveals that the early-stage oxidation of pure Zr single crystals is crystallography-dependent, with near-prismatic orientations oxidizing faster and forming thicker oxide films containing a homogeneous distribution of sub-oxides compared to basal orientations, while both follow a three-stage logarithmic kinetics.

Joaquin Sacanell, Flavio Conde2026-09-28
🔬 materials science

Retrainable physics-integrated neural differentiable modeling of sintering across material systems

The paper introduces Sinter-PiNDiff, a retrainable physics-integrated neural differentiable framework that accurately predicts sintering density and grain-size evolution across diverse material systems with sparse data, outperforming standard neural network baselines while highlighting the critical role of density-dependent kinetic feedback.

Zeping Chen, Ani Aprahamian, Khachatur V. Manukyan, Tengfei Luo2026-09-28
🔬 materials science

A Unified Spin-Fermion Framework for Magnetic Diversity in Chromium Monopnictides

This paper establishes a unified microscopic framework explaining the diverse magnetic behaviors in isoelectronic chromium monopnictides (CrSb, CrAs, CrP) by demonstrating how chemical pressure drives structural distortions and itinerancy changes that reconstruct competing exchange interactions, thereby transforming a common high-spin d5d^5 spin-fermion electronic structure into distinct magnetic phases ranging from altermagnetism to frustrated disorder.

Ruoshi Jiang, Bartomeu Monserrat2026-09-28
🔬 materials science

Low Speed Oblique Impact Behavior On Granular Media Across Gravitational Conditions; The role of cohesion

This study utilizes numerical and analytical modeling to demonstrate that cohesion significantly influences low-speed oblique impacts on granular media under low gravity, revealing that current scaling laws are insufficient and highlighting the need for new dimensionless parameters to accurately capture the complex interplay between cohesion, friction, and gravitational conditions.

Seungju Yeo, Rachel Glade, Alice Quillen, Hesam Askari2026-09-25