4 Commits

Author	SHA1	Message	Date
Oleg E. Peil	207c637be2	Restructured text-output routines ... 'main()' now calls a function 'output_as_text()' responsible for storing both a ctrl- and plo-files ('ctrl_output()' and 'plo_output()', respectively).	2015-10-11 13:57:46 +02:00
Oleg E. Peil	d794bfa0f5	Added output of a basic header into a ctrl-file ... Added function 'ctrl_ouput()' which stores data common for all correlated shells into a file '<basename>.ctrl'. At the moment, only a very basic header is output. The signature of 'plo_output()' is also modified to include an instance of class 'ElectronicStructre' containing important information on the lattice structure, Efermi, and k-points.	2015-10-11 13:57:46 +02:00
Oleg Peil	d0a75edec3	Added a simplest workflow to 'main.py' ... Simplest workflow: read config-file, vasp data, generate PLOs, and output them to text files.	2015-10-11 13:55:05 +02:00
Oleg E. Peil	5d8423a30e	Added preliminary 'main.py'	2015-10-11 13:55:05 +02:00