Publications using the hubbard package

This implementation of the hubbard package has been used in the listed publications below.

  1. J. Li, S. Sanz, M. Corso, D.J. Choi, D. Pena, T. Frederiksen and J.I. Pascual, Single spin localization and manipulation in graphene open-shell nanostructures, Nature Communications 10, 200 (2019)

  2. J. Li, S. Sanz, J. Castro-Esteban, M. Vilas-Varela, N. Friedrich, T. Frederiksen, D. Peña, J. I. Pascual, Uncovering the Triplet Ground State of Triangular Graphene Nanoflakes Engineered with Atomic Precision on a Metal Surface, Phys. Rev. Lett. 124, 177201 (2020)

  3. J. Li, S. Sanz, N. Merino-Díez, M. Vilas-Varela, A. Garcia-Lekue, M. Corso, D. G. de Oteyza, T. Frederiksen, D. Peña, and J. I. Pascual, Topological phase transition in chiral graphene nanoribbons: from edge bands to end states Nature Communications 12, 5538 (2021)

  4. J. Hieulle, S. Castro, N. Friedrich, A. Vegliante, F. Romero Lara, S. Sanz, D. Rey, M. Corso, T. Frederiksen, J. Ignacio Pascual, D. Peña, On-Surface Synthesis and Collective Spin Excitations of a Triangulene-Based Nanostar Angewandte Chemie International Edition 60 (48), 25224-25229 (2021)

  5. T. Wang, S. Sanz, J. Castro-Esteban, J. Lawrence, A. Berdonces-Layunta, M. S. G. Mohammed, M. Vilas-Varela, M. Corso, D. Peña, T. Frederiksen, and D. G. de Oteyza, Magnetic Interactions Between Radical Pairs in Chiral Graphene Nanoribbons Nano Letters 22, 1, 164-171 (2022)

  6. S. Sanz, N. Papior, G. Giedke, D. Sánchez-Portal, M. Brandbyge, T. Frederiksen, A spin-polarizing electron beam splitter from crossed graphene nanoribbons Phys. Rev. Lett. 129, 037701 (2022)

  7. S. Sanz, N. Papior, G. Giedke, D. Sánchez-Portal, M. Brandbyge, T. Frederiksen, Mach–Zehnder-like interferometry with graphene nanoribbon networks Submitted (2023) J. Phys.: Condens. Matter 35 374001 (2023)

  8. J. Brede, N. Merino-Díez, A. Berdonces, S. Sanz, A. Domínguez-Celorrio, J. Lobo-Checa, M. Vilas-Varela, D. Peña, T. Frederiksen, J. I. Pascual, D. G. de Oteyza, D. Serrate Detecting the spin-polarization of edge states in graphene nanoribbons Submitted (2023) Nature Communications 14, 6677 (2023)

Citing the hubbard package

If hubbard is used to produce scientific contributions please include citations, in addition to sisl, to the following Zenodo DOI:

@misc{dipc_hubbard,
  author       = {Sanz Wuhl, Sofia and
                  Papior, Nick and
                  Brandbyge, Mads and
                  Frederiksen, Thomas},
  title        = {hubbard: v<fill-version>},
  year         = {2023},
  doi          = {10.5281/zenodo.4748765},
  url          = {https://doi.org/10.5281/zenodo.4748765}
}

and also to the following works:

  • For molecules/periodic structures

@Article{Li2019,
  author={Li, Jingcheng
  and Sanz, Sofia
  and Corso, Martina
  and Choi, Deung Jang
  and Pe{\~{n}}a, Diego
  and Frederiksen, Thomas
  and Pascual, Jose Ignacio},
  title={Single spin localization and manipulation in graphene open-shell nanostructures},
  journal={Nature Communications},
  year={2019},
  month={Jan},
  day={14},
  volume={10},
  number={1},
  pages={200},
  issn={2041-1723},
  doi={10.1038/s41467-018-08060-6},
  url={https://doi.org/10.1038/s41467-018-08060-6}
}

and/or this

@article{Li2020,
  title = {Uncovering the Triplet Ground State of Triangular Graphene Nanoflakes Engineered with Atomic Precision on a Metal Surface},
  author = {Li, Jingcheng
  and Sanz, Sofia
  and Castro-Esteban, Jesus
  and Vilas-Varela, Manuel
  and Friedrich, Niklas
  and Frederiksen, Thomas
  and Pe\~na, Diego
  and Pascual, Jose Ignacio},
  journal = {Phys. Rev. Lett.},
  volume = {124},
  issue = {17},
  pages = {177201},
  numpages = {6},
  year = {2020},
  month = {Apr},
  publisher = {American Physical Society},
  doi = {10.1103/PhysRevLett.124.177201},
  url = {https://link.aps.org/doi/10.1103/PhysRevLett.124.177201}
}

  • For open boundary conditions:

@article{PhysRevLett.129.037701,
  title = {Spin-Polarizing Electron Beam Splitter from Crossed Graphene                             Nanoribbons},
  author = {Sanz, Sofia and Papior, Nick and Giedke, G\'eza and S\'anchez-Portal, Daniel and Brandbyge, Mads and Frederiksen, Thomas},
  journal = {Phys. Rev. Lett.},
  volume = {129},
  issue = {3},
  pages = {037701},
  numpages = {7},
  year = {2022},
  month = {Jul},
  publisher = {American Physical Society},
  doi = {10.1103/PhysRevLett.129.037701},
  url = {https://link.aps.org/doi/10.1103/PhysRevLett.129.037701}
}