https://github.com/jarvist/mapi-tb
(Work in Progress) Tight binding model for MAPI based on PythTB module.
https://github.com/jarvist/mapi-tb
mapi tight-binding
Last synced: 11 months ago
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(Work in Progress) Tight binding model for MAPI based on PythTB module.
- Host: GitHub
- URL: https://github.com/jarvist/mapi-tb
- Owner: jarvist
- Created: 2016-09-14T12:47:14.000Z (over 9 years ago)
- Default Branch: master
- Last Pushed: 2016-09-14T12:54:37.000Z (over 9 years ago)
- Last Synced: 2025-04-14T10:52:29.141Z (about 1 year ago)
- Topics: mapi, tight-binding
- Language: Python
- Size: 31.3 KB
- Stars: 0
- Watchers: 3
- Forks: 2
- Open Issues: 0
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Metadata Files:
- Readme: README.md
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README
# MAPI-TB
(Work in Progress) Tight binding model for MAPI based on the excellent [PythTB](http://physics.rutgers.edu/pythtb/) module [1].
The motivation is to build a tight-binding model of the electronic structure to
allow large scale calculations in disordered assemblies.

[1] http://physics.rutgers.edu/pythtb/