Code

Chiral GNRs and [n]-triangulene#644

Code

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zerothi merged 15 commits intozerothi:mainzerothi/sisl:mainfrom tfrederiksen:cgnrtfrederiksen/sisl:cgnrCopy head branch name to clipboardNov 22, 2023

+200-30

Commits

Commits on Nov 8, 2023

• enh: creation of chiral GNRs and [n]-triangulene

  tfrederiksen

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  a6df549

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• added tests for new geometries

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  71ae221

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• doc: introduced 0D section and new geometries

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• simple fixes

  tfrederiksen

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  fc3d8e7

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• adopted chirality for the (n, m)-index

  tfrederiksen

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  8bcbe55

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• redefined ribbon cell vectors and positioning in cells

  tfrederiksen

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  aa21049

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• chirality index unified and vacuum argument introduced for all ribbons

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  7746cf0

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• orthogonal cell for triangulene

  tfrederiksen

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  1b47a56

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• fix test_cgnr

  tfrederiksen

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• black fix

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• minor fixes

  tfrederiksen

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• nanoribbon atoms begin at zero along the first lattice vector (backwards compatibility)

  tfrederiksen

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  8c16eaa

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• vacuum as new parameter for heteroribbon

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  77dae38

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• final polish after rebase

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  e3482c5

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• added vacuum to docstring

  tfrederiksen

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