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TRIQS
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solid_dmft
solid_dmft is a versatile python wrapper to perform DFT+DMFT calculations utilizing the TRIQS software library.
https://triqs.github.io/solid_dmft/
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update Ce2O3 tutorial toml file
#89
InaPark93
closed
1 month ago
1
vasp h5 interface
#88
the-hampel
opened
1 month ago
0
updates on gw embedding and ctseg solver interface
#85
cnyeh
closed
2 months ago
1
error with mpirun solid_dmft: default.toml missing in pip package
#84
the-hampel
closed
3 months ago
0
Simplified solver interface for adding new solvers
#82
alberto-carta
closed
3 months ago
0
Bump docker/build-push-action from 5 to 6 in the batch group
#81
dependabot[bot]
closed
5 months ago
0
GW embedding
#80
cnyeh
closed
5 months ago
0
Bump actions/checkout from 2 to 4 in the batch group
#79
dependabot[bot]
closed
6 months ago
0
merge dev GW embedding (includes other fixes as well)
#78
the-hampel
closed
6 months ago
0
Update input of config file
#74
merkelm
closed
9 months ago
0
Broyden refactoring
#73
alberto-carta
opened
9 months ago
0
Only use basename as target to copy seed and config
#71
hmenke
closed
10 months ago
1
ci: build and cache base image separately
#70
hmenke
closed
10 months ago
0
Bump the batch group with 4 updates
#69
dependabot[bot]
closed
10 months ago
0
Add GitHub Actions workflow for Docker images
#66
hmenke
closed
11 months ago
1
Prototype for w2dyn_cthyb
#65
hmenke
opened
1 year ago
2
Support TRIQS/w2dynamics_interface
#64
hmenke
opened
1 year ago
0
Restore Python 3.8 compatibility for dictionary merge
#63
hmenke
closed
1 year ago
2
Deploy documentation using JamesIves/github-pages-deploy-action
#62
hmenke
closed
1 year ago
1
Allow mathematical expression to be passed for random_seed
#61
hmenke
closed
1 year ago
1
Error in running the second tutorial: CSC with VASP PLOs, PrNiO3
#59
the-hampel
closed
1 year ago
1
Adjust calls to k_space_path after TRIQS API change
#56
Wentzell
closed
1 year ago
0
[feat] enable MPI for maxent_gf_imp
#55
the-hampel
closed
1 year ago
2
Dyson solver with dlr and minimization
#52
harrisonlabollita
closed
8 months ago
1
add possibility to specify Uprime in Kanamori interaction
#51
the-hampel
closed
1 year ago
0
problem with plotting the spectral function
#50
Chen-Ziyan
opened
1 year ago
1
Remove functionality for series of calculations
#49
merkelm
closed
1 year ago
2
Fix to charge-self-consistency with Vasp
#48
merkelm
closed
1 year ago
1
Hartree solver
#47
alberto-carta
closed
1 year ago
0
QE fix
#46
alberto-carta
closed
1 year ago
0
Fixing QE DFT energy
#40
alberto-carta
closed
1 year ago
0
add RESPACK postprocessing routines
#38
the-hampel
closed
1 year ago
0
Add Hartree-Fock solver support
#37
the-hampel
closed
1 year ago
0
support different DFT cubic basis conventions
#36
harrisonlabollita
closed
2 years ago
1
Specifying dft_mu leads to wrong DC leads to wrong results
#35
phibeck
closed
2 years ago
5
PCB: use sumk to transform sigma from imp to latt
#33
the-hampel
closed
2 years ago
0
solver.py cthyb postprocessing is not using the tail fitted Sigma if tail fit is on
#31
the-hampel
closed
2 years ago
1
Added integration test for maxent gf imp and latt
#30
merkelm
closed
2 years ago
0
3.1.2 merge
#28
the-hampel
closed
2 years ago
0
new features for interactions and block structures
#27
the-hampel
closed
2 years ago
2
Changes to the JOSS paper for issue 23 and 24
#26
merkelm
closed
2 years ago
0
Update paper.md
#25
ghost
closed
2 years ago
0
Manuscript review
#24
amandadumi
closed
2 years ago
2
Review Suggestion: Minor paper edits
#23
shivupa
closed
2 years ago
2
Review Suggestion: Can tutorial folder be moved outside of doc/
#22
shivupa
closed
2 years ago
2
Review suggestion: Build script block at end of building from source section
#21
shivupa
closed
2 years ago
2
"Seeking Help" section in docs
#20
shivupa
closed
2 years ago
2
Update PCB module
#15
the-hampel
closed
2 years ago
0
adapt to sumk mesh changes in dfttools
#14
the-hampel
closed
2 years ago
0
merge common MPI helper functions
#13
the-hampel
closed
2 years ago
0
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