AOMix | AOMix-FO | FAQ | SWizard

AOMix FEEDBACK

Your feedback is appreciated and will be helpful in shaping the AOMix program development.

First Name:
Last Name:
Institution / Company:
E-mail:

How do you rate your experience with the AOMix software?

What software features do you find most useful? (select all appropriate choices from the list below and/or add your own)

MO compositions in terms of atomic contributions
MO compositions in terms of fragment MOs
overlap populations
density-of-states plots
overlap density-of-states plots
script for Gaussian CUBE files
Lowdin population analysis
Mayer bond orders
multi-center bond orders
atomic/fragment valence indices
recovery of wave functions from completed calculations
orbital interaction diagrams
comparisons of wave functions
the analysis of charge donation between fragments
generation of the new initial guess wave functions from fragment wave functions
energy decomposition analysis
Other:

What software features do you find hard to use?

What software features are not described in the AOMix manual with sufficient detail?

What software features would you want to be added in future releases?

What other improvements should be made to make the usage of the software more convinient/efficient?

What software packages do you use for AOMix calculations?

ADF
CNDO/INDO
GAMESS
Gaussian
Jaguar
HyperChem
MOPAC
Q-Chem
Spartan
Turbomole
ZINDO



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Last updated: May 2017