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Dr. Joaquin Barroso's Blog

Scientific log of a computational chemist – "Make like a molecule and React!"

Tag: chk files

3 Posts

Computational Chemistry, Gaussian, GaussView, Tricks, Visualization, White papers

fchk file errors (Gaussian) Missing or bad Data: RBond

December 14, 2017 — 3 Comments

Computational Chemistry, Gaussian, Tricks, White papers

Quick note on WFN(X) files and MP2 calculations #G09 #CompChem

June 28, 2016 — 5 Comments

Computational Chemistry, Gaussian, Tricks, Visualization, White papers

If a .fchk file wont open in GaussView5.0

May 7, 2014 — 26 Comments

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