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Python package for eigenchannels, vibrations and inelastic electron transport based on SIESTA/TranSIESTA DFT

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jonaslb/inelastica

 
 

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JonasLB's Inelastica branches

The mymaster branch contains the merge of a number of working branches not yet in upstream:

  • myreadme (for this alternate readme)
  • jinja adds jinja template ability (will probably never go upstream)
  • tiling: Replaces the old repeteGeom with a geometry tiling function which is much faster
  • py3shebang: All scripts have a python3 shebang
  • clean_tbt_se: Adds ability to use self-energies from tbtrans.

git checkout master && git pull upstream master && git push && git branch -D mymaster && git checkout -b mymaster && git merge myreadme jinja tiling py3shebang clean_tbt_se

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Python package for eigenchannels, vibrations and inelastic electron transport based on SIESTA/TranSIESTA DFT

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