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- In density functional theory (DFT) calculations, a
- Basis Sets
- So now we're going to look in detail at this type of
- Podcast for the computational chemistry students in the NCSSM Online program.
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00:52 Electron configurations for typical first, second, and third row elements 03:21 Minimal We discuss one-electron ("atomic orbital") 00:15 Gaussian type orbitals 01:37 GFInput text for carbon in 6-311G 02:03 color-coded GFInput text: number of Gaussians in ... So all these purposes sets actually
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