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This python-parser is a prototype of a future parser that will probably be using only LOCPROJ (which is going to be modified). At the moment, one has to use the first line of LOCPROJ to determine the array dimensions and parse PROJCAR because it contains relevant information on projectors (such as site and orbital character). Note that in the previous implementation relying on the binary PLOCAR-file the Fermi weights were taken from PLOCAR. In the current version of VASP (>=5.4.1) the Fermi weights can read in from EIGENVAL. |
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.. | ||
converters | ||
vasp | ||
__init__.py | ||
clear_h5_output.py | ||
CMakeLists.txt | ||
sumk_dft_tools.py | ||
sumk_dft.py | ||
symmetry.py | ||
trans_basis.py | ||
update_archive.py |