40 citations · 51 across the 4 of their papers we have counts for
4 papers
Magnetic Structures Database from Symmetry-aided High-Throughput Calculations
Hanjing Zhou, Yuxuan Mu, Dingwen Zhang +11
Magnetic structures-the spatial arrangement of magnetic moments-underpin the diverse functionalities of magnetic materials, yet they have been experimentally determined for only a…
Conjugate-dual clusters
Silei Wang, Jing Tian, Jiayu Li +5
Discovery of clusters with high symmetrical geometry, such as C60 fullerene, always attract lots of interest because of their diverse nature. However, most of such interesting clus…
Global optimization in the discrete and variable-dimension conformational space: The case of crystal with the strongest atomic cohesion
Guanjian Cheng, Xin-Gao Gong, Wan-Jian Yin
We introduce a computational method to optimize target physical properties in the full configuration space regarding atomic composition, chemical stoichiometry, and crystal structu…
What Is Armchair-Zigzag Grain Boundary Structure in Graphene?
Zheng-Lu Li, Hai-Yuan Cao, Ji-Hui Yang +4
We have developed a new global optimization method for the determination of interface structure based on the differential evolution algorithm. Here, we applied this method to searc…