Electronic, Optical, Mechanical and Li-Ion Storage Properties of Novel Benzotrithiophene-Based Graphdiyne Monolayers Explored by First Principles and Machine Learning

Mortazavi, Bohayra; Shojaei, Fazel; Shahrokhi, Masoud; Rabczuk, Timon; Shapeev, Alexander V; Zhuang, Xiaoying

by Bohayra Mortazavi, Fazel Shojaei, Masoud Shahrokhi, Timon Rabczuk, Alexander V Shapeev, Xiaoying Zhuang

Reference:

Electronic, Optical, Mechanical and Li-Ion Storage Properties of Novel Benzotrithiophene-Based Graphdiyne Monolayers Explored by First Principles and Machine Learning (Bohayra Mortazavi, Fazel Shojaei, Masoud Shahrokhi, Timon Rabczuk, Alexander V Shapeev, Xiaoying Zhuang), Batteries, MDPI, volume 8, 2022.

Bibtex Entry:

@article{mortazavi2022electronic,
  title={Electronic, Optical, Mechanical and Li-Ion Storage Properties of Novel Benzotrithiophene-Based Graphdiyne Monolayers Explored by First Principles and Machine Learning},
  author={Mortazavi, Bohayra and Shojaei, Fazel and Shahrokhi, Masoud and Rabczuk, Timon and Shapeev, Alexander V and Zhuang, Xiaoying},
  journal={Batteries},
  volume={8},
  number={10},
  pages={194},
  year={2022},
  publisher={MDPI}
}