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TRIQS/solid_dmft: Version 3.3.5

Authors: Nils Wentzell; Alexander Hampel; Dylan Simon; merkelm; Sophie Beck; Henri Menke; Alberto Carta; +8 Authors

TRIQS/solid_dmft: Version 3.3.5

Abstract

solid_dmft version 3.3.5 is a minor patch release that fixes several bugs and adds small features: fix afm mapping with hartree solver was missing copy of Sigma_Refreq afm calc with hartree solver was missing copy of DC_energy fix ctseg afm calculations reading DFT energy and iteration count from vaspout.h5 was broken numpy 2.x compatibility: explicit int cast for single-element arrays in observables explicit float cast in eval_U_cRPA_Vasp.py to remove spurious complex warning invalid escape sequence warnings in eval_U_cRPA_Vasp.py feat enable averaging of density correction by default for magnetic CSC calculations add mpi_exe config flag in [dft] section and update to latest VASP h5 interface add version printouts to stdout at the start of a calculation doc update NiO tutorial for ctseg afm calculations build use ctseg 3.3.x instead of unstable branch for 3.3.x docker image fix docker OpenMPI build by removing OMPI_MCA_btl_vader_single_copy_mechanism update GitHub Actions dependencies (docker actions, artifact upload/download actions) We thank all contributors: Alexander Hampel

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