[CHM 331] Lithium Hydride

[Andrew J. Pounds]

Students -- several of you have reported problems with getting results 
for lithium hydride on the Electron Densities capsule (exercise 1).

I was able to get mine to work by closing ALL but the main windiow, 
opening a new MolGroup, and then building Lithium Hydride by selecting 
the lithium atom from the periodic table and also selecting the single 
valence (the one on the right) lithium bonding scenario.

I did the optimization as requested and then built the total density 
cube with no problem after opening the Checkpoint file resulting from 
the optimization.

If you try this and still have problems please let me know.


-- 
Andrew J. Pounds, Ph.D.  (pounds at theochem.mercer.edu)
Associate Professor of Chemistry and Computer Science
Mercer University,  Macon, GA 31207   (478) 301-5627