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[doc] fix typo in doi id of DC function

This commit is contained in:
Alexander Hampel 2024-04-09 09:55:02 -04:00
parent 41eac4475a
commit 0eda780024

View File

@ -34,25 +34,25 @@ def compute_DC_from_density(N_tot, U, J, N_spin=None, n_orbitals=5, method='sF
Parameters
----------
N_tot : float
N_tot : float
Total density of the impurity
N_spin : float , default = None
Spin density, defaults to N_tot*0.5 if not specified
U : float
U : float
U value
J : float
J : float
J value
n_orbitals : int, default = 5
Total number of orbitals
method : string, default = 'cFLL'
method : string, default = 'cFLL'
possibilities:
- cFLL: DC potential from Ryee for spin unpolarized DFT: (DOI: 10.1038/s41598-018-27731-4)
- sFLL: same as above for spin polarized DFT
- cAMF: around mean field
- sAMF: spin polarized around mean field
- cHeld: unpolarized Held's formula as reported in (DOI: 10.1103/PhysRevResearch.2.03308)
- cHeld: unpolarized Held's formula as reported in (DOI: 10.1103/PhysRevResearch.2.033088)
- sHeld: NOT IMPLEMENTED
Returns
-------
List of floats:
@ -60,7 +60,7 @@ def compute_DC_from_density(N_tot, U, J, N_spin=None, n_orbitals=5, method='sF
- E_val: double counting energy
todo:
todo:
- See whether to move this to TRIQS directly instead of dft_tools
- allow as input full density matrix to allow orbital dependent DC
"""