activity
20142026
most citedComplex low energy tetrahedral polymorphs of group IV elements from first-principles

143 citations · 439 across the 18 of their papers we have counts for

collaborators

18 papers

cond-mat.mtrl-sci2026

Phonon-Localization-Driven Decoupling of Dual-Channel Transport for Record-Low Intrinsic Lattice Thermal Conductivity

Zhunyun Tang, Xiaoxia Wang, Jin Li +4

A fundamental bottleneck in pushing the intrinsic lattice thermal conductivity of inorganic crystalline solids to its lowest limit arises from the inherent competition between the…

cond-mat.mtrl-sci2026

High-Throughput Discovery of Semimetallic Borophenes with Diverse Dirac States Via Transferable Tight-Binding Approach

Yuke Song, Shifang Li, Tao Ouyang +3

Borophene has attracted extensive interest due to its structural flexibility and emergent topological electronic states. However, semimetallic borophenes hosting robust Dirac state…

cond-mat.mtrl-sci2025★ 6 cited

Unique Hierarchical Rotational Dynamics Induces Ultralow Lattice Thermal Conductivity in Cyanide-bridged Framework Materials

Zhunyun Tang, Xiaoxia Wang, Jin Li +4

The pursuit of materials combining light constituent elements with ultralow lattice thermal conductivity () is crucial to advancing technologies like thermoelectric…

cond-mat.mes-hall2025

First-principles predictions of the diversity in atomic structures and electronic properties of the reconstructed Si(111)-7x7 surface

Yuke Song, ShiFang Li, PeiZe Lin +4

The 7x7 reconstruction of Si(111) surface is widely understood by the dimer-adatom-stacking-fault model (DAS), but the predicted metallicity of DAS contradicts experimental signs o…

cond-mat.mes-hall2024

Isolated zero-energy flat-bands and intrinsic magnetism in carbon monolayers

Chaoyu He, Shifang Li, Yuwen Zhang +3

Flat-band in twisted graphene bilayer has garnered widespread attention, and whether flat-bands can be realized in carbon monolayer is an interesting topic worth exploring in conde…

cond-mat.mtrl-sci2023

Vertical Ferroelectricity in Van der Waals Materials: Models and Devices

Yuwen Zhang, Chunfeng Cui, Chaoyu He +4

Ferroelectricity has a wide range of applications in functional electronics and is extremely important for the development of next-generation information storage technology, but it…