plotpl

This repository consist of minimal data that can be used to plot connical intersection data from calculated MECP. I will be updating my blog and provide a link to the whole procedure using the Q-chem Program.

-If you are in a hurry, send me an email request aloonyokinda@gmail.com

Name		Name	Last commit message	Last commit date
Latest commit History 2 Commits
.ipynb_checkpoints		.ipynb_checkpoints
3dplot.py		3dplot.py
README.md		README.md
Untitled.ipynb		Untitled.ipynb
ch3.csv		ch3.csv
ch3.py		ch3.py
ch3.xlsx		ch3.xlsx
ch3_ci_trial.png		ch3_ci_trial.png
ch3_plot.svg.svg		ch3_plot.svg.svg
data.csv		data.csv
es_scan_data.csv		es_scan_data.csv
new_ev.data		new_ev.data
row.csv		row.csv
set2.csv		set2.csv
tableformat.csv		tableformat.csv
trial.csv		trial.csv
trial.ipynb		trial.ipynb
trisurf3d_demo.py		trisurf3d_demo.py
~$ch3.xlsx		~$ch3.xlsx

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