March 2016 Archives by thread

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Starting: Fri Mar 4 08:34:22 CET 2016
Ending: Wed Mar 30 16:44:32 CEST 2016
Messages: 22

• [molpro-user] Job Failure   Apostolos Kalemos
  • [molpro-user] Job Failure   Andy May
• [molpro-user] CASPT3 geometry optimization without imaginary shift.   Dawid das
• [molpro-user] How Much Memory is Needed for Molpro?   王黎明
  • [molpro-user] How Much Memory is Needed for Molpro?   Kirk Peterson
• [molpro-user] CCSD calcuation   behnam nikoobakht
  • [molpro-user] CCSD calcuation   Tatiana Korona
• [molpro-user] Molpro Installation Problem   Andy May
• [molpro-user] CCSD/eom   behnam nikoobakht
  • [molpro-user] CCSD/eom   Tatiana Korona
• [molpro-user] u-ccsd/f12 calculation fails   DE BRUIN Theodorus
  • [molpro-user] u-ccsd/f12 calculation fails   王黎明
    • [molpro-user] u-ccsd/f12 calculation fails   Klaus Doll
• [molpro-user] error when using DKH hamiltonian   Lorenzo Lodi
• [molpro-user] lcc2, save excitation energies in au   Mara Osswald
  • [molpro-user] lcc2, save excitation energies in au   Tatiana Korona
• [molpro-user] restart   Bauschlicher, Charles W. (ARC-TS)
• [molpro-user] mrci   Bauschlicher, Charles W. (ARC-TS)
• [molpro-user] FCI convergence threshold   Jacek Koput
  • [molpro-user] FCI convergence threshold   Peter Knowles
• [molpro-user] definition of quad   Taube, Andrew
• [molpro-user] How is Pople correction calculated.   Dawid das

Last message date: Wed Mar 30 16:44:32 CEST 2016
Archived on: Wed Mar 30 17:34:19 CEST 2016

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