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Dr. Joaquin Barroso's Blog

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

Tag: Wave Function

3 Posts

Computational Chemistry, Excited State, Gaussian, Models, Quantum Mechanics, Theoretical Chemistry, White papers

Is your Wavefunction stable?

August 10, 2023 — 6 Comments

Mathematics, Philosophy, Quantum Mechanics, Random thoughts, Theoretical Chemistry

The contradictory “complexity” of the wave function

June 6, 2023 — 0 Comments

Computational Chemistry, Gaussian, Tricks, White papers

Fixing the error: Bad data into FinFrg

November 8, 2021 — 0 Comments

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