bond orders

Ali RNAlo... at gmail.com
Tue May 20 19:28:19 UTC 2008

Previous message (by thread): CFP: 3rd Annual CMM Workshop on QM/MM Simulations
Next message (by thread): bond orders
Messages sorted by: [ date ] [ thread ] [ subject ] [ author ]

Dear CP2K Users,

Is there any *easy* way to print out the bond orders between atoms in
a system?

Ali

Previous message (by thread): CFP: 3rd Annual CMM Workshop on QM/MM Simulations
Next message (by thread): bond orders
Messages sorted by: [ date ] [ thread ] [ subject ] [ author ]

More information about the CP2K-user mailing list