A high-efficient strain-stress method for calculating higher-order elastic constants from first-principles

Mingqing Liao, Yong Liu, Fei Zhou, Tianyi Han, Danni Yang, Nan Qu, Zhonghong Lai, Zi-Kui Liu, Jingchuan Zhu. A high-efficient strain-stress method for calculating higher-order elastic constants from first-principles. Computer Physics Communications, 280:108478, 2022. [doi]

@article{LiaoLZHYQLLZ22,
  title = {A high-efficient strain-stress method for calculating higher-order elastic constants from first-principles},
  author = {Mingqing Liao and Yong Liu and Fei Zhou and Tianyi Han and Danni Yang and Nan Qu and Zhonghong Lai and Zi-Kui Liu and Jingchuan Zhu},
  year = {2022},
  doi = {10.1016/j.cpc.2022.108478},
  url = {https://doi.org/10.1016/j.cpc.2022.108478},
  researchr = {https://researchr.org/publication/LiaoLZHYQLLZ22},
  cites = {0},
  citedby = {0},
  journal = {Computer Physics Communications},
  volume = {280},
  pages = {108478},
}