416 citations · 906 across the 14 of their papers we have counts for
14 papers
Data-Efficient Adaptation of DPA-4 Force Fields to DFT+U Energetics: A Case Study in NiO
Fengyu Xie, Peiheng Jiang, Zhicheng Zhong
Foundation machine-learned force fields (MLFFs) are often pretrained on broad materials datasets whose electronic-structure conventions may not reproduce the phase energetics requi…
Dual instability of superconductivity from oxygen defects in LaNiO
Peiheng Jiang, Jie Li, Yu-Han Cao +4
We uncover a dual mechanism by which oxygen defects suppress superconductivity in the bilayer nickelate LaNiO using density functional theory, dynamical mean-field…
Temperature-driven structural phase transitions in SmNiO: insights from deep potential molecular dynamics simulations
Guoyong Shi, Fenglin Deng, Ri He +4
The metal-insulator transition (MIT) in rare-earth nickelates exemplifies the intricate coupling between lattice dynamics and electronic effects. This strong interplay makes it cha…
Charge and spin instabilities in superconducting LaNiO
Xuejiao Chen, Peiheng Jiang, Jie Li +2
Motivated by the recent discovery of superconductivity in LaNiO under high pressure, we explore its potential charge and spin instabilities through combined model analy…
Zero-Point Quantum Diffusion of Proton in Hydrogen-rich Superconductor
Xuejian Qin, Hongyu Wu, Guyong Shi +3
, as a member of hydrogen-rich superconductors, has a superconducting critical temperature of 250 K at high pressures, which exhibits the possibility of solving the long-…
Magnetism in doped infinite-layer NdNiO2 studied by combined density functional theory and dynamical mean-field theory
Dachuan Chen, Peiheng Jiang, Liang Si +2
The recent observation of superconductivity in infinite-layer nickelates has brought intense debate on the established knowledge of unconventional superconductivity based on the cu…
Antiferromagnetism in Ni-Based Superconductors
Xiaorong Zhou, Xiaowei Zhang, Jiabao Yi +16
Due to the lack of any magnetic order down to 1.7 K in the parent bulk compound NdNiO2, the recently discovered 9-15 K superconductivity in the infinite-layer Nd0.8Sr0.2NiO2 thin f…
Lateral modulation of magnetic anisotropy in tricolor 3d-5d oxide superlattices
Zengxing Lu, Jingwu Liu, Lijie Wen +10
Manipulating magnetic anisotropy (MA) purposefully in transition metal oxides (TMOs) enables the development of oxide-based spintronic devices with practical applications. Here, we…
Observation of an Unusual Colossal Anisotropic Magnetoresistance Effect in an Antiferromagnetic Semiconductor
Huali Yang, Qing Liu, Zhaoliang Liao +11
Searching for novel antiferromagnetic materials with large magnetotransport response is highly demanded for constructing future spintronic devices with high stability, fast switchi…
Polarity induced electronic and atomic reconstruction at NdNiO2/SrTiO3 interfaces
Ri He, Peiheng Jiang, Yi Lu +5
Superconductivity has recently been observed in Sr-doped NdNiO2 films grown on SrTiO3. Whether it is caused by or related to the interface remains an open question. To address this…
Electric-field-controllable high-spin SrRuO3 driven by a solid ionic junction
Jingdi Lu, Liang Si, Xiefei Yao +16
Controlling magnetism and spin structures in strongly correlated systems by using electric field is of fundamental importance but challenging. Here, a high-spin ruthenate phase is…
Electronic structure of rare-earth infinite-layer ReNiO2 (Re=La, Nd)
Peiheng Jiang, Liang Si, Zhaoliang Liao +1
The discovery of infinite layer nickelate superconductor marks the new era in the field of superconductivity. In the rare-earth (Re) nickelates ReNiO2, although the Ni is also of d…
Stacking tunable interlayer magnetism in bilayer CrI3
Peiheng Jiang, Cong Wang, Dachuan Chen +4
Diverse interlayer tunability of physical properties of two-dimensional layers mostly lies in the covalent-like quasi-bonding that is significant in electronic structures but rathe…
Spin direction controlled electronic band structure in two dimensional ferromagnetic CrI3
Peiheng Jiang, Lei Li, Zhaoliang Liao +2
Manipulating physical properties using the spin degree of freedom constitutes a major part of modern condensed matter physics and is very important for spintronics devices. Using t…