December 2007 Archives by thread

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Starting: Sun Dec 2 12:00:09 GMT 2007
Ending: Mon Dec 31 17:23:56 GMT 2007
Messages: 34

• [molpro-user] error in CASPT2 calculation   Chen Hui
  • [molpro-user] error in CASPT2 calculation   Chen Hui
• [molpro-user] using DF in UMP2   Glen Jenness
• [molpro-user] run molpro in parallel with sge   Javier Díaz Montes
• [molpro-user] Killing Molpro Jobs using SGE   Javier Díaz Montes
  • [molpro-user] Killing Molpro Jobs using SGE   Reuti
    • [molpro-user] Killing Molpro Jobs using SGE   Javier Díaz Montes
  • [molpro-user] Killing Molpro Jobs using SGE   Javier Díaz Montes
    • [molpro-user] Killing Molpro Jobs using SGE   Reuti
      • [molpro-user] Killing Molpro Jobs using SGE   Javier Díaz Montes
    • [molpro-user] Killing Molpro Jobs using SGE   Javier Díaz Montes
• [molpro-user] About very large memory usage in molpro2006   Chen Hui
• [molpro-user] Basis set specification   Lorenzo Lodi
  • [molpro-user] Basis set specification   Kirk Peterson
    • [molpro-user] Basis set specification   Lorenzo Lodi
      • [molpro-user] Basis set specification   Kirk Peterson
• [molpro-user] About detailed error message for filled disk space   Min Seung Kyu
  • [molpro-user] About detailed error message for filled disk space   Peter Knowles
    • [molpro-user] About detailed error message for filled disk space   Min Seung Kyu
      • [molpro-user] About detailed error message for filled disk space   Peter Knowles
• [molpro-user] Why energy(2)<energy(1)?   张世扬
• [molpro-user] Possible bug in the DKH module in molpro 2006.1   Lorenzo Lodi
• [molpro-user] LICENCE! Password missing on licence token   Aristotle Papakondylis
• [molpro-user] molpro licence for serial version fails   SLIM H.A.
  • [molpro-user] molpro licence for serial version fails   Reuti
• [molpro-user] Quadrupolar polarizabilities   Wright Timothy
  • [molpro-user] Quadrupolar polarizabilities   Tatiana Korona
    • [molpro-user] Quadrupolar polarizabilities   Wright Timothy
      • [molpro-user] Quadrupolar polarizabilities   Tatiana Korona
• [molpro-user] help regarding MRCI calculations   rama chandran
• [molpro-user] CI singles from SCF reference - spin symmetry issue   Dan Haxton
  • [molpro-user] CI singles from SCF reference - spin symmetry issue   Tatiana Korona
  • [molpro-user] Re: CI singles from SCF reference - spin symmetry issue   Dan Haxton
• [molpro-user] Diagonal non-adiabatic corrections   rama chandran

Last message date: Mon Dec 31 17:23:56 GMT 2007
Archived on: Fri Apr 4 12:08:37 BST 2014

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