October 2007 Archives by thread

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Starting: Thu Oct 11 00:24:44 BST 2007
Ending: Wed Oct 31 10:54:40 GMT 2007
Messages: 13

• [molpro-user] What is spin ordering in doubly occupied CI vector entries?   Dr. Seth Olsen
• [molpro-user] acml error   Glen Jenness
• [molpro-user] {SPAM}? Using ECP with Molpro   lin
  • [molpro-user] {SPAM}? Using ECP with Molpro   Grant Hill
    • [molpro-user] {SPAM}? Using ECP with Molpro   Grant Hill
• [molpro-user] State Averaging in MULTI   Jeremy Merritt
• [molpro-user] localized orbitals   Falcetta, Michael F.
• [molpro-user] Deleteing virtual orbitals from correlation calculations   Falcetta, Michael F.
• [molpro-user] precision problems in calculationg Hessian matrix   张世扬
• [molpro-user] MRCI iterations problem.   Wang Mingwei
  • [molpro-user] MRCI iterations problem.   Manhui Wang
• [molpro-user] DFT restart   Peter Reinhardt
• [molpro-user] Some error in Conical Intersection Otimaization   Chenggang Ci

Last message date: Wed Oct 31 10:54:40 GMT 2007
Archived on: Fri Apr 4 12:08:37 BST 2014

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