Published July 26, 2020
| Version v1
Dataset
Open
ePSproc: Naphthalene S1 component Orb 34 > 42 (B3u) ionization, 1.0 - 30.1 eV
Description
Naphthalene S1 component Orb 34 > 42 (B3u) ionization, 1.0 - 30.1 eV - photoionization calculations with ePolyScat (ePS) + ePSproc.
*Web version*: https://phockett.github.io/ePSdata/naphthalene/naphthalene_wf_1.0-30.1eV_orb34-42_S1.html
For more details of the calculations, see readme.txt, or:
*Web version*: https://phockett.github.io/ePSdata/naphthalene/naphthalene_wf_1.0-30.1eV_orb34-42_S1.html
For more details of the calculations, see readme.txt, or:
Files
naphthalene_wf_1.0-30.1eV_orb34-42_S1.ipynb
Files
(60.7 MB)
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