[molpro-user] MCRESTRICT
Yann P. Tambouret
yannpaul at bu.edu
Fri Aug 5 21:52:52 BST 2005
Molpro-user group,
Has any one run multi by defining the RAS using MCRESTRICT variable?
Could you please send an example of doing this. I reported an issue I
had with it previously, twice:
http://www.molpro.net/molpro-user/archive/all/msg01430.html
http://www.molpro.net/molpro-user/archive/all/msg01469.html
The last error comes when I try to define all but the restrictions using
the special variables and the set command.
I just want to make sure I'm using this correctly before I submit a bug
report.
Thanks,
Yann
More information about the Molpro-user
mailing list