Firefly and PC GAMESS-related discussion club
Learn how to ask questions correctly
Difference between excited state and ground state density
Michal Krompiec
michal.krompiec@merckgroup.com
Hi, how can I generate a CUBE file for the difference in electron density between a chosen excited state and the ground state? If it is not possible directly, can I subtract the respective CUBEs with some external software? (other than ChemCraft)
Wed Jun 8 '16 4:09pm
This message read 738 times