How to properly utilise sisl to extract information from potential
See original GitHub issueGood day all,
I was wondering in the sisl manual it focuses on extracting the information from RHO.grid.nc
files to produce cube files in the following format:
sgrid PG.DeltaRho.grid.nc --geometry zeroPG.XV --diff P.DeltaRho.grid.nc --diff G.DeltaRho.grid.nc diffn.cube
My questions are as follow:
1- Is there a similar format for Electrostatic.grid.nc
, TotalPotential.grid.nc
, and TotalCharge.grid.nc
files?
2- If i am interested only in one direction such as z-axis, how command should I use?
3- What available output formats can be done and how?
Thank you and looking forward to your reply. EL-abed
Issue Analytics
- State:
- Created 3 years ago
- Comments:15 (8 by maintainers)
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sure 😃
Please do not re-open an old question with new questions…