C

computational chemistry

Projects with this topic

Grier Jones / FeOML_Data

dataset Python Persistent H...
+ 4 more

1

Updated Feb 05, 2024

1 0 0 0

Updated Feb 05, 2024
H

Leopold Lindenbauer / Hartree-Fock Tutorial

Jupyter Notebook working out the HF-Method for H2 with STO-3G - also a (quite steep) python primer.

chemistry quantum chem... computationa...
+ 1 more

1

Updated Mar 07, 2019

1 1 0 0

Updated Mar 07, 2019