Published January 24, 2020
| Version v1
Dataset
Open
ePSproc: ABCO wavefn run, HOMO ioinzation (A1), 0.5:1:10.5, orb 31
Description
ABCO wavefn run, HOMO ioinzation (A1), 0.5:1:10.5, orb 31 - photoionization calculations with ePolyScat (ePS) + ePSproc.
*Web version*: https://phockett.github.io/ePSdata/ABCO/ABCO_0.01-5.01eV_orb31_A1.html
For more details of the calculations, see readme.txt, or:
Files
ABCO_0.01-5.01eV_orb31_A1.ipynb
Files
(147.8 MB)
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