{
"file": "/mnt/Store/epsmanTests/ABCO/ABCO_1-50eV_orb30_E.ipynb",
"doi": "10.5281/zenodo.3627353",
"title": "ABCO 1st attempt, orb 30 ioinzation (E)",
"jobInfo": [
"",
"***Reading notebook: /mnt/Store/epsmanTests/ABCO/ABCO_1-50eV_orb30_E.ipynb",
" ePS ABCO, batch ABCO_1-50eV, orbital orb30_E",
" ABCO 1st attempt, orb 30 ioinzation (E), symm testing",
" E=1:1:50 (50 points)",
" Thu Mar 2 19:20:37 EST 2017",
"",
"Electronic structure input: '/media/hockettp/StoreM/ePolyScat_stuff/ABCO/electronic_structure/ABCO_E_cc-pVDZ_C3v.molden'"
],
"E": [
"1",
"1",
"50",
"50"
],
"pkg": true,
"jRoot": "1-50eV.*orb30_E",
"pkgInfo": [
"",
"***Pkg dry run",
"Arch: /mnt/Store/epsmanTests/ABCO/pkg/ABCO_1-50eV_orb30_E.zip",
"jRoot: 1-50eV.*orb30_E",
"rePat: .*1-50eV.*orb30_E.*$(?
*Web version*: https://phockett.github.io/ePSdata/ABCO/ABCO_1-50eV_orb30_E.html
For more details of the calculations, see readme.txt, or: