Citing

If you are considering citing the SimStack in your thesis, paper, or presentation, the following references can provide you with the necessary information to do so:

• SimStack’s paper:

  • BibTeX:

    @article{Rego_simstack_2022,
      author    = {Celso R. C. R{\^{e}}go and Jörg Schaarschmidt and Tobias Schlöder and Montserrat Penaloza-Amion and Saientan Bag and Tobias Neumann and Timo Strunk and Wolfgang Wenzel},
      journal   = {Frontiers in Materials},
      title     = {{SimStack}: An Intuitive Workflow Framework},
      year      = {2022},
      volume    = {9},
      doi       = {10.3389/fmats.2022.877597},
      publisher = {Frontiers Media {SA}}
    }
    

• Metal-Organic Frameworks paper:

  • BibTeX:

    @article{Mostaghimi_2022,
      author    = {Mersad Mostaghimi and Celso R. C. R{\^{e}}go and Ritesh Haldar and Christof Wöll and Wolfgang Wenzel and Mariana Kozlowska},
      journal   = {Frontiers in Materials},
      title     = {Automated Virtual Design of Organic Semiconductors Based on Metal-Organic Frameworks},
      year      = {2022},
      month     = {mar},
      volume    = {9},
      doi       = {10.3389/fmats.2022.840644},
      publisher = {Frontiers Media {SA}},
    }
    

• Workflow Engineering in Materials Design paper:

  • BibTeX:

    @article{Schaarschmidt_2021,
      author    = {Joerg Schaarschmidt and Jie Yuan and Timo Strunk and Ivan Kondov and Sebastiaan P. Huber and Giovanni Pizzi and Leonid Kahle and Felix T. Bölle and Ivano E. Castelli and Tejs Vegge and Felix Hanke and Tilmann Hickel and Jörg Neugebauer and Celso R. C. R{\^{e}}go and Wolfgang Wenzel},
      journal   = {Advanced Energy Materials},
      title     = {Workflow Engineering in Materials Design within the {BATTERY} 2030 $\less$b$\greater$$\mathplus$$\less$/b$\greater$ Project},
      year      = {2021},
      month     = {dec},
      number    = {17},
      pages     = {2102638},
      volume    = {12},
      doi       = {10.1002/aenm.202102638},
      publisher = {Wiley},
    }