Yu Xin

collaborators

2 papers

cond-mat.mtrl-sci2025

Bridging Theory and Experiment in Materials Discovery: Machine-Learning-Assisted Prediction of Synthesizable Structures

Yu Xin, Peng Liu, Zhuohang Xie +6

Even though thermodynamic energy-based crystal structure prediction (CSP) has revolutionized materials discovery, the energy-driven CSP approaches often struggle to identify experi…

cond-mat.mtrl-sci2024

Creating cyclo-N $_{5}$ $^{+}$ cation and assembling N $_{5}$ $^{+}$ N $_{5}$ $^{-}$ salt via electronegativity co-matching in tailored ionic compounds

Bi Zhang, Yu Xin, Meiling Xu +4

The recent discovery of crystalline pentazolates marks a major advance in polynitrogen science and raises prospects of making the long-touted potent propellant N $_{5}$ $^{+}$ N $_{5}$ $^{-…

Bridging Theory and Experiment in Materials Discovery: Machine-Learning-Assisted Prediction of Synthesizable Structures

Creating cyclo-N5​+ cation and assembling N5​+N5​− salt via electronegativity co-matching in tailored ionic compounds

Creating cyclo-N $_{5}$ $^{+}$ cation and assembling N $_{5}$ $^{+}$ N $_{5}$ $^{-}$ salt via electronegativity co-matching in tailored ionic compounds