From the 24 of 409 papers with an AI index.
94 citations
- Tsinghua UniversityCN114 papers
- University of Chinese Academy of SciencesCN109 papers
- South China Normal UniversityCN84 papers
- Istituto Nazionale di Fisica Nucleare, Laboratori Nazionali di FrascatiIT83 papers
- Istituto Nazionale di Fisica Nucleare, Sezione di PerugiaIT83 papers
- University of BristolGB83 papers
- Massachusetts Institute of TechnologyUS74 papers
- University of Maryland, College ParkUS74 papers
- University of Science and Technology of ChinaCN74 papers
- Université Paris-SaclayFR73 papers
- University of ZurichCH73 papers
- Eötvös Loránd UniversityHU70 papers
16 papers · 1 filter
Temperature-driven sodium-ion dynamical-to-static crossover in the zig-zag ordered phase of NaCoO
Shangfei Wu, Hengxin Tan, Dong Wu +7
The study combines polarization‑resolved Raman spectroscopy and first‑principles calculations to reveal a temperature‑driven dynamical‑to‑static crossover of sodium ions in Na0.5Co…
Subsurface Vacancy Engineering Enables Atomically Clean and Oxidation-Resistant Copper Interfaces for Anode-Free Lithium Metal Batteries
Yue Li, Xuanguang Ren, Xueting Feng +8
Interfaces govern reaction pathways and stability in electrochemical systems, yet creating clean, well-defined metal interfaces at scale remains challenging. In anode-free lithium…
Orbital Altermagnetism in Two Dimensions
Mingxiang Pan, Feng Liu, Huaqing Huang
We introduce the concept of \emph{orbital altermagnetism}, a symmetry-protected magnetic order of pure orbital degrees of freedom. It is characterized with ordered anti-parallel or…
Extending Field Limits in Nanoscale Magnetic Imaging with Metamaterial-inspired Magnetic Flux Concentrators
A. Barrera, E. Fourneau, T. Pirottin +14
Many nanoscale magnetic imaging techniques are constrained by the maximum magnetic field that can be applied during measurements, due to geometrical limitations or interactions wit…
A Unified Heterogeneous Implementation of Numerical Atomic Orbitals-Based Real-Time TDDFT within the ABACUS Package
Taoni Bao, Yuanbo Li, Zichao Deng +6
We present a unified heterogeneous computing framework for real-time time-dependent density functional theory (RT-TDDFT) based on numerical atomic orbitals (NAOs), implemented in t…
Ward identities and orbital magnetization in current density functional theory
Giovanni Vignale, Junren Shi, Di Xiao +1
We revisit the derivation of the orbital magnetization formula for periodic crystals in current density functional theory (CDFT)[1]. Our new derivation computes the linear response…