Computational Nanoscience, Lecture 15: In-Class Simulations: Hartree-Fock
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| Category | Teaching Materials |
|---|---|
| Abstract | Using a range of examples, we study the effect of basis set on convergence, the Hartree-Fock accuracy compared to experiment, and explore a little bit of molecular chemistry. |
| Cite this work | Researchers should cite this work as follows: |
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