August 2013 Archives by date

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Starting: Thu Aug 1 13:53:30 BST 2013
Ending: Sat Aug 31 07:04:35 BST 2013
Messages: 40

• [molpro-user] Error prior to EOM-CCSD iterations (failure in dsyev , The problem occurs in diag2)   Andy May
• [molpro-user] a question out of curiosity   Rajagopala Reddy seelam
• [molpro-user] a question out of curiosity   Rajagopala Reddy seelam
• [molpro-user] Error prior to EOM-CCSD iterations (failure in dsyev , The problem occurs in diag2)   Evgeniy Gromov
• [molpro-user] Error prior to EOM-CCSD iterations (failure in dsyev , The problem occurs in diag2)   Andy May
• [molpro-user] MPI Error   Andy May
• [molpro-user] MPI Error   Quandt, Robert
• [molpro-user] MPI Error   Andy May
• [molpro-user] Problem with spin-orbit calculation   s13mc107 at mail.saitama-u.ac.jp
• [molpro-user] scf problem during optg   Pawel Kadlubanski
• [molpro-user] scf problem during optg   Werner Győrffy
• [molpro-user] Problem with spin-orbit calculation   Andy May
• [molpro-user] RS2C, excessive norm in internal space   A.Zech at stud.uni-heidelberg.de
• [molpro-user] MCSCF convergence in OPTG   Hrusak Jan
• [molpro-user] AIMS trajectory starting from saddle point   Gabriel Freitas
• [molpro-user] memory problems with ccsd(t)-f12   Simmie, John
• [molpro-user] Subject: oscillatory strength calculation by eom-ccsd method   Arpita Ghosh
• [molpro-user] Subject: oscillatory strength calculation by eom-ccsd method   Tatiana Korona
• [molpro-user] How to fix molecule in center of mass coordinates   yule at iccas.ac.cn
• [molpro-user] How to fix molecule in center of mass coordinates   Jayashree
• [molpro-user] Adding orbitals in a set of output orbitals   aurelie perveaux
• [molpro-user] Adding orbitals in a set of output orbitals   Shachar Klaiman
• [molpro-user] No imaginary frequency but SURF cannot run   Kenny W
• [molpro-user] No imaginary frequency but SURF cannot run   Guntram Rauhut
• [molpro-user] Is it a bug about LZZ expection ?   Peter Knowles
• [molpro-user] error in test jobs   bhaskar sharma
• [molpro-user] Problem with reading saved orbitals record - molpro 2012.1...   Lukasz Serafin
• [molpro-user] Problem with reading saved orbitals record - molpro 2012.1...   Peter Knowles
• [molpro-user] Problem regarding IRC with method QSDPATH   G Mahesh
• [molpro-user] Problem regarding IRC with method QSDPATH   Ramon Hernandez
• [molpro-user] Problem regarding IRC with method QSDPATH   G Mahesh
• [molpro-user] selection of CAS   A.Zech at stud.uni-heidelberg.de
• [molpro-user] Problem regarding IRC with method QSDPATH   Ramon Hernandez
• [molpro-user] Problem regarding IRC with method QSDPATH   G Mahesh
• [molpro-user] error in test jobs   Andy May
• [molpro-user] error in test jobs   bhaskar sharma
• [molpro-user] error in test jobs   Andy May
• [molpro-user] error in test jobs   bhaskar sharma
• [molpro-user] selection of CAS   Peter Knowles
• [molpro-user] error   bhaskar sharma

Last message date: Sat Aug 31 07:04:35 BST 2013
Archived on: Fri Apr 4 12:08:51 BST 2014

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