Pull requests: dftbplus/dftbplus
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Non-collinear hybrids for molecules
enhancement
work in progress
#1428
opened Apr 1, 2024 by
bhourahine
•
Draft
4 of 5 tasks
Periodic contacts
bug
library: negf
Related to libnegf external dependency (transport)
#1301
opened Aug 13, 2023 by
bhourahine
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10 tasks done
Start of Coulomb setup for xTB pt charges
enhancement
Hamiltonian: xTB
Related to the extended tight-binding Hamiltonian
work in progress
#1246
opened May 25, 2023 by
bhourahine
•
Draft
5 of 11 tasks
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