Extensions for TranSiesta/TBtrans

Registered by Nick Papior on 2017-11-13

A list of things to implement in transiesta/tbtrans

Blueprint information

Status:
Not started
Approver:
Nick Papior
Priority:
Undefined
Drafter:
Nick Papior
Direction:
Needs approval
Assignee:
Nick Papior
Definition:
Approved
Series goal:
None
Implementation:
Unknown
Milestone target:
None

Related branches

Sprints

Whiteboard

This is a list of things I (Nick) want to add to transiesta/tbtrans, it is meant as a safe-keeper of TODO notes

(?)

Work Items

Work items:
Check atomic print-out in TBtrans (see e.g. exercise TB_02): DONE
Allowing full device transport (electrode part of device): TODO
Transmission eigenchannels: TODO
Transport for spin-orbit: TODO
TSDE interpolation like TSHS (for faster convergence in bias calculations: TODO
Allow dH/dSE in transiesta: TODO
Ensure memory deallocation when transiesta/tbtrans has completed: TODO

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