Category:Electronic ground-state properties

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At the end of an electronic minimization, VASP obtained a converged set of orbitals. From the orbitals, we compute the corresponding density via k-point integration. The orbitals and the density reveal important insights into material properties and are often the first step towards analyzing and understanding a material.

Properties of orbitals

Subcategories

This category has the following 7 subcategories, out of 7 total.

Pages in category "Electronic ground-state properties"

The following 12 pages are in this category, out of 12 total.