@misc{indiciae09d149dc9b4e,
  title = {Constrained nuclear–electronic orbital method for periodic density functional theory: Application to H 2 chemisorption on Si(001) surfaces},
  author = {Liu, Songrui [Peking University, Beijing (China); University of North Carolina, Chapel Hill, NC (United States)] (ORCID:0009000496898763) and Xu, Jianhang [University of North Carolina, Chapel Hill, NC (United States)] (ORCID:0000000262536201) and Kanai, Yosuke [University of North Carolina, Chapel Hill, NC (United States)] (ORCID:0000000223204394)},
  year = {2025},
  doi = {10.1063/5.0278375},
  url = {https://www.osti.gov/biblio/2943088},
  note = {Source identifier: 2943088}
}