February 2016 Archives by thread

• Messages sorted by: [ subject ] [ author ] [ date ]

Starting: Wed Feb 3 08:33:47 CET 2016
Ending: Fri Feb 26 10:52:04 CET 2016
Messages: 40

• [molpro-user] Print the CI vector in RS2 and RS2C   José Cortés
• [molpro-user] Excited-state CASPT3 geometry optimization.   Dawid das
• [molpro-user] DF-LUCCSD(T)-F12: Local=1 not possible for ansatz 3*A(LOC, FIX)   Martin Diefenbach
  • [molpro-user] unrestricted DF-LUCCSD(T)-F12   Martin Diefenbach
    • [molpro-user] unrestricted DF-LUCCSD(T)-F12   Grant Hill
      • [molpro-user] unrestricted DF-LUCCSD(T)-F12   Hans-Joachim Werner
      • [molpro-user] unrestricted DF-LUCCSD(T)-F12   Martin Diefenbach
      • [molpro-user] unrestricted DF-LUCCSD(T)-F12   Martin Diefenbach
• [molpro-user] set electric field   Diego Cesario
  • [molpro-user] set electric field   Changjian Xie
• [molpro-user] Convergence problem in multi   rudraditya sarkar
• [molpro-user] Molpro Installation Problem   pcsm2 at iacs.res.in
  • [molpro-user] Molpro Installation Problem   Andy May
  • [molpro-user] Molpro Installation Problem   pcsm2 at iacs.res.in
    • [molpro-user] Molpro Installation Problem   Andy May
      • [molpro-user] Molpro Installation Problem   pcsm2 at iacs.res.in
      • [molpro-user] Molpro Installation Problem   Andy May
• [molpro-user] F12 integrals   Ewa Szreder
• [molpro-user] Problem with molpro_key   Greeves, Nick
  • [molpro-user] Problem with molpro_key   Andy May
• [molpro-user] Convergence Problem for CASSCF   김갑수
• [molpro-user] STATE directive in RS2 and RS3.   Dawid das
  • [molpro-user] STATE directive in RS2 and RS3.   Grant Hill
  • [molpro-user] STATE directive in RS2 and RS3.   Kirk Peterson
• [molpro-user] Size consistency issue   george
  • [molpro-user] Size consistency issue   Kirk Peterson
  • [molpro-user] Size consistency issue   Lorenzo Lodi
  • [molpro-user] Size consistency issue   george
• [molpro-user] norm of internals in MRCI   Dumitru SERGENTU
• [molpro-user] Optg and Frequencies   Apostolos Kalemos
• [molpro-user] Molpro configs and rigid optimisation   Daniel Nurkowski
  • [molpro-user] Molpro configs and rigid optimisation   Andy May
• [molpro-user] ADC2 run   behnam nikoobakht
  • [molpro-user] ADC2 run   Tatiana Korona
• [molpro-user] Installation problem with make command   Cayo Emilio
  • [molpro-user] Installation problem with make command   Andy May
    • [molpro-user] Installation problem with make command   Cayo Emilio
      • [molpro-user] Installation problem with make command   Andy May
• [molpro-user] query regarding SAMC directive   Satyam Srivastava
• [molpro-user] DFT density matrix   Diego Cesario

Last message date: Fri Feb 26 10:52:04 CET 2016
Archived on: Fri Feb 26 11:49:28 CET 2016

• Messages sorted by: [ subject ] [ author ] [ date ]