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DCDFTBMD

DCDFTBMD

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DCDFTBMD

Documentation

  Consult these for the detailed description of all possible features, keywords and options.

  • DCDFTBMD manual (English ver.)
  • DCDFTBMD manual (Japanese ver.)

ver 1.0

  • DCDFTBMD ver .1.0 manual (English ver.)
  • DCDFTBMD ver. 1.0 manual (Japanese ver.)

 

Language Switcher

  • English
  • 日本語

Recent Posts

  • Paper on Hierarchical Parallelization of DC-DFTB-MD/MTD was adopted in Cover Image of J. Comput. Chem.
  • “DCDFTBMD” and “RAQET” software papers has been recognized as 2018-2019 top download papers
  • Large-scale quantum molecular dynamics simulation software “DCDFTBMD” (ver. 2.0) has been released since January 1st, 2020
  • Paper on Polaron Formation in Perovskite Solar Cell was selected as PCCP 2019 HOT Articlesf J. Chem. Theory Comput.
  • Review paper on Ubiquitous Proton was adopted in Cover Image of WIREs Comput. Mol. Sci.

Original paper

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