Combined ReaxFF and Ab Initio MD Simulations of Brown Coal Oxidation and Coal-Water Interactions

Shi Yu, Ruizhi Chu, Xiao Li, Guoguang Wu, Xianliang Meng. Combined ReaxFF and Ab Initio MD Simulations of Brown Coal Oxidation and Coal-Water Interactions. Entropy, 24(1):71, 2022. [doi]

@article{YuCLWM22,
  title = {Combined ReaxFF and Ab Initio MD Simulations of Brown Coal Oxidation and Coal-Water Interactions},
  author = {Shi Yu and Ruizhi Chu and Xiao Li and Guoguang Wu and Xianliang Meng},
  year = {2022},
  doi = {10.3390/e24010071},
  url = {https://doi.org/10.3390/e24010071},
  researchr = {https://researchr.org/publication/YuCLWM22},
  cites = {0},
  citedby = {0},
  journal = {Entropy},
  volume = {24},
  number = {1},
  pages = {71},
}