August 2014 Archives by thread

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Starting: Fri Aug 1 07:52:29 BST 2014
Ending: Thu Aug 28 21:33:09 BST 2014
Messages: 19

• [molpro-user] Problems with multi and rotate   Stefan Mattsson
• [molpro-user] Transition Moments in CASPT2   Alan Chien
• [molpro-user] I/O error with large basis sets   Alan
• [molpro-user] CI   Jacek Koput
• [molpro-user] error with PROC   C. Franklin Goldsmith
  • [molpro-user] error with PROC   Peterson, Kirk
    • [molpro-user] error with PROC   C. Franklin Goldsmith
      • [molpro-user] error with PROC   Peterson, Kirk
• [molpro-user] which would be the best hardware investment for future Molpro versions ?   Benj FitzPatrick
• [molpro-user] Numerical gradients   Thorsten Stolper
• [molpro-user] problems restarting a conical intersection optimization with a wfu-file   Patrick.Koelle
  • [molpro-user] wrong casscf reference energy for rs2c   ZOUWL
• [molpro-user] Error in Spin-Orbit Calculation   Samir Tohme
  • [molpro-user] Error in Spin-Orbit Calculation   Peterson, Kirk
    • [molpro-user] Error in Spin-Orbit Calculation   Samir Tohme
    • [molpro-user] Error in Spin-Orbit Calculation   Peterson, Kirk
      • [molpro-user] Error in Spin-Orbit Calculation   Samir Tohme
• [molpro-user] MOLPRO Installation   G Mahesh

Last message date: Thu Aug 28 21:33:09 BST 2014
Archived on: Fri Aug 29 07:59:23 BST 2014

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