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mirror of https://github.com/triqs/dft_tools synced 2025-05-01 04:34:57 +02:00
Alexander Hampel 2a8acf45a3
new VASP 6.5.0 hdf5 support capability (#262)
* [vasp] read fermi from vasp h5 archive and write deltaN to vasp h5 archive
* Reading vasptriqs.h5 file; reading GAMMA file for non-collinear full csc
* fix read error for tetrahedron data and eigs properties
* write deltaN only to vasp h5 if present, write to GAMMA text file only for old interface
* support symmetries at DFT level in VASP
* use IBZ kpoint list for writing GAMMA vaspgamma.h5
* make vaspgamma.h5 default
* write n_k_ibz into dft_misc_input so in can be used inside of sumk
* add new svo converter test

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Co-authored-by: Dario Fiore Mosca <fiosca@Darios-MacBook-Air.local>
2025-01-09 20:44:31 +01:00
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2022-11-10 11:11:28 -05:00