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DFTB+ Step

  • Getting Started
  • User Guide
  • Developer Documentation
  • API Documentation
    • DFTB+ documentation
    • Credits
    • History
    • SEAMM Documentation
    • MolSSI
  • GitHub
  • Twitter
  • Getting Started
  • User Guide
  • Developer Documentation
  • API Documentation
  • DFTB+ documentation
  • Credits
  • History
  • SEAMM Documentation
  • MolSSI
  • GitHub
  • Twitter
  • Overview: module code

All modules for which code is available

  • dftbplus_step.band_structure
  • dftbplus_step.band_structure_parameters
  • dftbplus_step.band_structure_step
  • dftbplus_step.base
  • dftbplus_step.choose_parameters
  • dftbplus_step.choose_parameters_parameters
  • dftbplus_step.choose_parameters_step
  • dftbplus_step.computational_models
  • dftbplus_step.dftbplus
  • dftbplus_step.dftbplus_parameters
  • dftbplus_step.dftbplus_step
  • dftbplus_step.dos
  • dftbplus_step.dos_parameters
  • dftbplus_step.dos_step
  • dftbplus_step.energy
  • dftbplus_step.energy_parameters
  • dftbplus_step.energy_step
  • dftbplus_step.installer
  • dftbplus_step.optimization
  • dftbplus_step.optimization_parameters
  • dftbplus_step.optimization_step
  • dftbplus_step.slako
  • dftbplus_step.tk_band_structure
  • dftbplus_step.tk_choose_parameters
  • dftbplus_step.tk_dftbplus
  • dftbplus_step.tk_dos
  • dftbplus_step.tk_energy
  • dftbplus_step.tk_optimization

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