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1.2 KiB
1.2 KiB
Relativistic magnetic interactions from non-orthogonal basis sets
TODO
- Definition of magnetic entities:
- Through simple sequence o forbitals in the unit cell
- Through atom specification
- Through atom and orbital specification
- Separation of TR and TRB components of the Hamiltonian, Identification of the exchange field.
- Definition of commutator expressions, old projection matrix elements
- Efficient calculation of Green's functions
- Calculation of energy and momentum resolved derivatives
- Parallel BZ and serial energy integral
Building wheel
See detailed documentation on PYPI.
Use the following commands for a quick setup:
- Build wheel
python -m build
Build wheel:
Push to pypi(testpypi for beginners): python3 -m twine upload --repository testpypi dist/*
Ehhez kellenek tokenek: You will be prompted for a username and password. For the username, use token. For the password, use the token value, including the pypi- prefix.
Végfelhasználóknak (egyelőre testpypi): python3 -m pip install --index-url https://test.pypi.org/simple/ example-package-YOUR-USERNAME-HERE