LCPQ/dft_tools
3
0
Fork 0
mirror of https://github.com/triqs/dft_tools synced 2024-12-22 04:13:47 +01:00
Code Issues Releases Wiki Activity

small fix to dft_dmft_cthyb.py

Browse Source
This commit is contained in:
Priyanka Seth 2015-08-03 16:40:39 +02:00
parent b6e33ecc23
commit 8911eac67c
1 changed files with 6 additions and 0 deletions
Show Stats Download Patch File Download Diff File Expand all files Collapse all files

6
dft_dmft_cthyb.py
View File

@ -60,10 +60,16 @@ h_int = h_int_density(spin_names, orb_names, map_operator_structure=SK.sumk_to_s
S = Solver(beta=beta, gf_struct=gf_struct) S = Solver(beta=beta, gf_struct=gf_struct)
if previous_present: if previous_present:
chemical_potential = 0
dc_imp = 0
dc_energ = 0
if mpi.is_master_node(): if mpi.is_master_node():
S.Sigma_iw << HDFArchive(dft_filename+'.h5','a')['dmft_output']['Sigma_iw'] S.Sigma_iw << HDFArchive(dft_filename+'.h5','a')['dmft_output']['Sigma_iw']
chemical_potential,dc_imp,dc_energ = SK.load(['chemical_potential','dc_imp','dc_energ']) chemical_potential,dc_imp,dc_energ = SK.load(['chemical_potential','dc_imp','dc_energ'])
S.Sigma_iw << mpi.bcast(S.Sigma_iw) S.Sigma_iw << mpi.bcast(S.Sigma_iw)
chemical_potential = mpi.bcast(chemical_potential)
dc_imp = mpi.bcast(dc_imp)
dc_energ = mpi.bcast(dc_energ)
SK.set_mu(chemical_potential) SK.set_mu(chemical_potential)
SK.set_dc(dc_imp,dc_energ) SK.set_dc(dc_imp,dc_energ)