1 citations · 2 across the 5 of their papers we have counts for
4 papers · 1 filter
Spinless electric toroidal multipoles in ferroaxial revealed by symmetry-adapted closest Wannier analysis
Yu Xie, Rikuto Oiwa, Satoru Hayami
From a symmetry perspective, ferroaxial order belongs to the same symmetry as time-reversal-even pseudovectors. Experimentally, is known to undergo a displaci…
Domain-Wall Mediated Polarization Switching in Ferroelectric AlScN: Strain Relief and Field-Dependent Dynamics
Xiangyu Zheng, Charles Paillard, Dawei Wang +4
While scandium-doped aluminum nitride (AlScN) exhibits robust ferroelectricity and excellent thermal stability, its utility is limited by an exceptionally high coercive field ($E_c…
Self-Optimizing Machine Learning Potential Assisted Automated Workflow for Highly Efficient Complex Systems Material Design
Jiaxiang Li, Junwei Feng, Jie Luo +9
Machine learning interatomic potentials have revolutionized complex materials design by enabling rapid exploration of material configurational spaces via crystal structure predicti…
Electron--phonon matrix elements from eigenvalue projection within the projector augmented-wave method
Qian Wang, Jiaxiang Li, Yanming Ma +1
We present a finite-displacement approach to electron--phonon matrix elements that requires only eigenvalues and wave functions from the displaced calculations, for both norm-conse…