calculate_u-function
This is an old revision of the document!
U - function
This page shows how to calculate U - function to correct the gap of molecules.
</code> 14 ! number of el 5 ! number of orbitals 6 7 8 10 22 </code>
calculate_u-function.1352286937.txt.gz · Last modified: 2012/11/07 12:15 (external edit)
Except where otherwise noted, content on this wiki is licensed under the following license: CC Attribution-Noncommercial-Share Alike 4.0 International
