596 citations · 809 across the 11 of their papers we have counts for
11 papers
AI-accelerated metallized -bonding screening for superconductor discovery
Zechen Tang, Wen-Han Dong, Baochun Wu +11
The computational discovery of phonon-mediated superconductors is hindered by the prohibitive cost of density functional perturbation theory (DFPT). Here, guided by the metallized…
DeePMD-kit v3: A Multiple-Backend Framework for Machine Learning Potentials
Jinzhe Zeng, Duo Zhang, Anyang Peng +44
In recent years, machine learning potentials (MLPs) have become indispensable tools in physics, chemistry, and materials science, driving the development of software packages for m…
Picosecond-scale Heterogeneous Melting of Metals at Extreme Non-equilibrium States
Qiyu Zeng, Xiaoxiang Yu, Bo Chen +4
Extreme electron-ion non-equilibrium states, generated by ultrafast laser excitation, lead to melting processes that are fundamentally different from those under conventional therm…
Thermal conductivity of MgO in giant planetary interior conditions predicted by deep potential
Rong Qiu, Qiyu Zeng, Ke Chen +2
Thermal conductivity of MgO plays a fundamental role in understanding the thermal evolution and mantle convection in the interior of terrestrial planets. However, previous theo…
Full-scale ab initio simulations of laser-driven atomistic dynamics
Qiyu Zeng, Bo Chen, Shen Zhang +4
The coupling of excited states and ionic dynamics is the basic and challenging point for the materials response at extreme conditions. In laboratory, the intense laser produces tra…
DeePMD-kit v2: A software package for Deep Potential models
Jinzhe Zeng, Duo Zhang, Denghui Lu +44
DeePMD-kit is a powerful open-source software package that facilitates molecular dynamics simulations using machine learning potentials (MLP) known as Deep Potential (DP) models. T…
Non-Hermitian skin effect edge
Qi-Bo Zeng
Non-Hermitian skin effect (NHSE) is a unique phenomenon studied intensively in non-Hermitian systems during the past few years. In this work, we discuss the energy dependence of NH…
Three-step Formation of Diamonds in Shock-compressed Hydrocarbons: Decomposition, Species Separation, and Nucleation
Bo Chen, Qiyu Zeng, Xiaoxiang Yu +4
The accumulation and circulation of carbon-hydrogen dictate the chemical evolution of ice giant planets. Species separation and diamond precipitation have been reported in carbon-h…
Towards Large-Scale and Spatio-temporally Resolved Diagnosis of Electronic Density of States by Deep Learning
Qiyu Zeng, Bo Chen, Xiaoxiang Yu +4
Modern laboratory techniques like ultrafast laser excitation and shock compression can bring matter into highly nonequilibrium states with complex structural transformation, metall…
Reduced Ionic Diffusion by the Dynamic Electron-Ion Collisions in Warm Dense Hydrogen
Yunpeng Yao, Qiyu Zeng, Ke Chen +4
The dynamic electron-ion collisions play an important rolein determining the static and transport properties of warmdense matter (WDM). Electron force field (eFF) method is applied…
Atomistic Mechanism of Phase Transition in Shock Compressed Gold Revealed by Deep Potential
Bo Chen, Qiyu Zeng, Han Wang +4
A detailed understanding of the material response to rapid compression is challenging and demanding. For instance, the element gold under dynamic compression exhibits complex phase…