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210 papers · 1 filter
Magnetic precession induced spin accumulation in collinear antiferromagnets
Q. Xue, J. Zhou
Generating and characterizing uniform and staggered spin polarization in antiferromagnets is one of the key challenges for antiferromagnetic spintronic technology. Here, we perform…
Benchmarking Chemically Scalable Machine-Learning Interatomic Potentials for Large-Scale Simulations of Multicomponent Alloys
Fei Shuang, Penghua Ying, Kai Liu +5
Machine learning interatomic potentials (MLIPs) with broad chemical flexibility are essential for atomistic simulations of compositionally complex alloys, but their deployment in l…
Sliding Ferroelectricity Induced and Switched Altermagnetism in GaSe-VPSe3-GaSe Sandwiched Heterostructure with Strong Magnetoelectric Effect
Pengqiang Dong, Hanbo Sun, Chao Wu +1
Magnetoelectric coupling is vital for exploring fundamental science and driving the development of high-density memory and energy-efficient spintronic devices. Altermagnets, which…
LLM-driven discovery for carbon allotropes with bond-network entropy
Yuzhou Hao, Yujie Liu, Xuejie Li +4
The discovery of novel carbon allotropes with tailored thermal and mechanical properties is critical for advanced thermal management. However, exploring the vast configurational sp…
Role of octahedral tilting induced acoustic softening on limiting thermal transport in SrSnO3
Yuzhou Hao, Turab Lookman, Xiangdong Ding +2
Octahedral tilting is a fundamental structural distortion in perovskites, governing key phenomena such as lattice stabilizing, soft phonon dynamics, group-theoretical analysis, pha…
Microstructural origin of the simultaneous enhancements in strength and ductility of a nitrogen-doped high-entropy alloy
Xiaoxiang Wu, Zhujun Sun, Wenqi Guo +9
As one of the most abundant interstitial elements, nitrogen (N) is effective in improving yield strength of metallic materials, due to interstitial solid solution strengthening. Do…