Repositories list

• Stilde-Interpretation-and-Visualization

  Public
  A program to sort and analyze large amounts of specific rotation analysis data. Then, using PyMol to superimpose vectors from the sorted data set onto molecules

  optical-rotationvisualizationmolecule+ 1pymol

  Python

  •1•1•0•0•Updated Jul 17, 2022Jul 17, 2022

• .github

  Public
  Group Description for Public display

  0•0•0•0•Updated Mar 30, 2022Mar 30, 2022

• CHEM-Course-Code

  Public
  Programs written by students in the Spring 2015 iteration of CHEM 850: Advanced Quantum Chemistry at the University of Kansas

  hartree-fockelectronic-structurecoupled-cluster

  Fortran

  •

  MIT License

  •0•0•0•0•Updated Jun 16, 2021Jun 16, 2021

• HartreeFock

  Public
  Simple Restricted Hartree Fock collaborative project

  hartree-fockelectronic-structure

  Python

  •

  GNU General Public License v3.0

  •0•0•0•0•Updated Sep 2, 2020Sep 2, 2020

• Multi-State-Extrapolation

  Public
  Program to extrapolate UV/Vis spectra from QM/QM excited state calculations

  spectroscopyoniom

  Perl

  •

  GNU General Public License v3.0

  •0•0•0•0•Updated Jun 30, 2020Jun 30, 2020