1. Fahim Z, Santos-Florez P. A., Zhu Q (2025). Atomistic Modeling of Martensitic Phase Transition in Hexamethylbenzene CrystEngComm, DOI: 10.1039/D5CE00078E

  2. Zhu Q, Hattori S. (2025). Automated High-throughput Organic Crystal Structure Prediction via Population-based Sampling Digital Discovery, 4, 120-134 (Open Access: PDF)

  3. Parrish K, Hu Q-Y, Zhu Q (2025). PyLRO: A Python Calculator for Analyzing Long-Range Structural Order J. Appl. Phys. 137, 025101 (2025)

  4. Gao X-X, Zhang K, Zhu Q, Chen C-F, Liu C (2025). Setting material benchmarks at large-strain limits via ultimate strengths Acta Mater. 286, 120724

  5. Liu C, Mukta M, Kang B, Zhu Q (2025). Semiconducting Electrides Derived From Sodalite: A First-principles Study ACS Omega, 10, 1, 1635–1642

  6. Hou J, Zhu Q, Weng X-J, Shao X, Dong X, Wang H-T, Zhou X-F, Tian Y-J (2025). Prediction of Cyclic O6 Molecules Stabilized by Helium under Pressure Adv. Sci., 2415517

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