62 citations · 116 across the 4 of their papers we have counts for
4 papers
High-throughput computation and structure prototype analysis for two-dimensional ferromagnetic materials
Zhen-Xiong Shen, Chuanxun Su, Lixin He
We perform high-throughput first-principles computations to search the high Curie temperature () two-dimensional ferromagnetic (2DFM) materials. We identify 79 2DFM mate…
Shared Metadata for Data-Centric Materials Science
Luca M. Ghiringhelli, Carsten Baldauf, Tristan Bereau +32
The expansive production of data in materials science, their widespread sharing and repurposing requires educated support and stewardship. In order to ensure that this need helps r…
Construction of crystal structure prototype database: methods and applications
Chuanxun Su, Jian Lv, Quan Li +4
Crystal structure prototype data have become a useful source of information for materials discovery in the fields of crystallography, chemistry, physics, and materials science. Thi…
ATLAS: A Real-Space Finite-Difference Implementation of Orbital-Free Density Functional Theory
Wenhui Mi, Xuecheng Shao, Chuanxun Su +8
Orbital-free density functional theory (OF-DFT) is a promising method for large-scale quantum mechanics simulation as it provides a good balance of accuracy and computational cost.…