Data extraction from DOS-DOSCAR

[madhu_menon2]

Hi,
I am wondering if there are tools available for extracting PDOS for each orbital from the file DOS-DOSCAR. I used LORBIT=11 to output the needed orbital projections ( p_x, p_y, p_z, d_xy, d_yz etc). The file is too large. Is there a tool that can extract this output for a select number of atoms? Thanks.

[merzuk.kaltak]

Hi,

you may use p4vasp, which has an export feature and can be installed via

Code: Select all

apt-get install p4vasp

on debian based systems.
Alternatively, there is also the promising sumo project that is based on other python packages.