manual   quickstart   instguide   update   basis

Next: Beyond LMP2 treatment of Up: New features of MOLPRO2015.1 Previous: Intrinsic bond-orbital analysis and   PDF

Interface to NBO6

Molpro 2015 supports NBO6 Natural Bond Orbital Analysis (NBO6) via an interface. NBO6 must be licensed separately.



molpro@molpro.net 2017-09-24