This group is intended to provide a forum for open discussion on all aspects of installing and using the MOLPRO quantum chemistry package. It is intended as the primary means of disseminating hints and tips on how to use Molpro effectively. It is not a means of raising queries directly with the authors of the program. For clearly demonstrable program errors, reports should be emailed to molpro@molpro.net. however, 'how-to' questions sent there will probably be redirected back to this forum.

The old molpro-user archives can be found here.

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Spin-Orbit with MRCI+Q

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