March 2013 Archives by author

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Starting: Fri Mar 1 00:48:17 GMT 2013
Ending: Thu Mar 28 19:17:14 GMT 2013
Messages: 26

• [molpro-user] MCSCF problem with convergence   Benj FitzPatrick
• [molpro-user] Large System MCSCF/MRCIC Calculations in Parallel   Jason Goodpaster
• [molpro-user] Possible bug in precompiled binary   Kliewer, Konrad C.
• [molpro-user] noncanonical orbitals in CCSD-F12   Gerald Knizia
• [molpro-user] Strange Occupation Numbers for CIS Natural Orbitals   Tatiana Korona
• [molpro-user] MCSCF problem with convergence   Tatiana Korona
• [molpro-user] Memory usage in Molpro   Kelvin Lee
• [molpro-user] Strange Occupation Numbers for CIS Natural Orbitals   Benjamin Levine
• [molpro-user] Basis set cc-pV(6+d)Z in molpro for sulfur   Lorenzo Lodi
• [molpro-user] STOP Maxdir   Andy May
• [molpro-user] Nonconvergence with constraints   Andy May
• [molpro-user] Nonconvergence with constraints   Andy May
• [molpro-user] Basis set cc-pV(6+d)Z in molpro for sulfur   Andy May
• [molpro-user] MCSCF problem with convergence   Aris Mitropoulos
• [molpro-user] Basis set cc-pV(6+d)Z in molpro for sulfur   Kirk Peterson
• [molpro-user] Molpro across multiple Macs   Kirk Peterson
• [molpro-user] noncanonical orbitals in CCSD-F12   Mariusz Radon
• [molpro-user] Molpro across multiple Macs   Jean M. Standard
• [molpro-user] Parallel MOLPRO   Manhui Wang
• [molpro-user] Memory usage in Molpro   Manhui Wang
• [molpro-user] about UHF mix HOMO-LUMO ?   Yingjin
• [molpro-user] Problems with the IRC optimization   yule at iccas.ac.cn
• [molpro-user] query   diwaker kumar
• [molpro-user] query   diwaker kumar
• [molpro-user] STOP Maxdir   c00jsh00 at nchc.narl.org.tw
• [molpro-user] atomic MRCI calculation   이천우

Last message date: Thu Mar 28 19:17:14 GMT 2013
Archived on: Fri Apr 4 12:08:48 BST 2014

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