mirror of
https://github.com/triqs/dft_tools
synced 2025-05-02 05:04:57 +02:00
2a8acf45a3
* [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 --------- Co-authored-by: Dario Fiore Mosca <fiosca@Darios-MacBook-Air.local>
17 lines
234 B
INI
17 lines
234 B
INI
[General]
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BASENAME = converter/svo
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[Group 1]
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SHELLS = 1
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NORMALIZE = True
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EWINDOW = -1.4 2.0
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[Shell 1]
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LSHELL = 2
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IONS = 2
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TRANSFORM = 1.0 0.0 0.0 0.0 0.0
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0.0 1.0 0.0 0.0 0.0
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0.0 0.0 0.0 1.0 0.0
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