March 2005 Archives by author

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Starting: Tue Mar 1 12:43:55 CET 2005
Ending: Wed Mar 30 20:08:05 CEST 2005
Messages: 60

• [CPMD-list] no changes in trajectory   Younes Ansari
• [CPMD-list] calculation of pair correlation function   Younes Ansari
• [CPMD-list] problem with pair correlation function   Younes Ansari
• [CPMD-list] nanocrystals   Prof. Sushil Auluck
• [CPMD-list] Questions: CPMD make warning & run anomally(?)   John Kofi Dogbe
• [CPMD-list] Questions: CPMD make warning & run anomally(?)   John Kofi Dogbe
• [CPMD-list] Questions: CPMD make warning & run anomally(?)   John Kofi Dogbe
• [CPMD-list] Questions: CPMD make warning & run anomally(?)   John Kofi Dogbe
• [CPMD-list] Questions: CPMD make warning & run anomally(?)   John Kofi Dogbe
• [CPMD-list] cpmd2cube does not compile   Wolfgang Fritsch
• [CPMD-list] Re: CPMD-list Digest, Vol 11, Issue 1   Yvan Girard
• [CPMD-list] Re: CPMD-list Digest, Vol 11, Issue 2   Yvan Girard
• [CPMD-list] About getting surface energy in CPMD   Wone Keun Han
• [CPMD-list] Units in geometry files   Michael Hawlitzky
• [CPMD-list] About molecular point groups   Juerg Hutter
• [CPMD-list] calculation of pair correlation function   Juerg Hutter
• [CPMD-list] opeigr.F   Juerg Hutter
• [CPMD-list] problem with pair correlation function   Juerg Hutter
• [CPMD-list] grid on real space   Juerg Hutter
• [CPMD-list] grid on real space   Juerg Hutter
• [CPMD-list] Equilibration of organic molecules in water   Keta Jones
• [CPMD-list] Equilibration of organic molecules in water   Keta Jones
• [CPMD-list] About getting surface energy in CPMD   Hong Won Keon
• [CPMD-list] Getting lattice constant of Pt bulk   Hong Won Keon
• [CPMD-list] ADJMU| BISECTION COULD NOT   Eung-Gun Kim
• [CPMD-list] &BASIS PSEUDO AO format for Pt(18e)   Eung-Gun Kim
• [CPMD-list] cpmd2cube does not compile   Axel Kohlmeyer
• [CPMD-list] no changes in trajectory   Axel Kohlmeyer
• [CPMD-list] md-run: crystal seems to explode   Axel Kohlmeyer
• [CPMD-list] Equilibration of organic molecules in water   Axel Kohlmeyer
• [CPMD-list] Equilibration of organic molecules in water   Axel Kohlmeyer
• [CPMD-list] "MEMORY| ALLOCATION FAILED" error message   Axel Kohlmeyer
• [CPMD-list] Questions: CPMD make warning & run anomally(?)   Axel Kohlmeyer
• [CPMD-list] lattice constant of magnesium-oxide   Axel Kohlmeyer
• [CPMD-list] Questions: CPMD make warning & run anomally(?)   Axel Kohlmeyer
• [CPMD-list] problem with pair correlation function   Axel Kohlmeyer
• [CPMD-list] Questions: CPMD make warning & run anomally(?)   Axel Kohlmeyer
• [CPMD-list] Questions: CPMD make warning & run anomally(?)   Axel Kohlmeyer
• [CPMD-list] serial and parallel gradients differ   Axel Kohlmeyer
• [CPMD-list] Getting lattice constant of Pt bulk   Axel Kohlmeyer
• [CPMD-list] &BASIS PSEUDO AO format for Pt(18e)   Axel Kohlmeyer
• [CPMD-list] opeigr.F   Zhenyu LI
• [CPMD-list] grid on real space   Zhenyu LI
• [CPMD-list] grid on real space   Zhenyu LI
• [CPMD-list] Calculating the acivation energy   Dai Ling
• [CPMD-list] About molecular point groups   Erik Santiso
• [CPMD-list] About getting surface energy in CPMD   Ari P Seitsonen
• [CPMD-list] serial and parallel gradients differ   Ari P Seitsonen
• [CPMD-list] nanocrystals   Ari P Seitsonen
• [CPMD-list] Getting lattice constant of Pt bulk   Ari P Seitsonen
• [CPMD-list] md-run: crystal seems to explode   Nico.Zobel at TU-Berlin.DE
• [CPMD-list] lattice constant of magnesium-oxide   Nico.Zobel at TU-Berlin.DE
• [CPMD-list] "MEMORY| ALLOCATION FAILED" error message   Robert Williams
• [CPMD-list] VDW   Robert Williams
• [CPMD-list] serial and parallel gradients differ   Robert Williams
• [CPMD-list] Gauss-Hermite vs Kleinman-Bylander, VDW-CELL   Robert Williams
• [CPMD-list] &BASIS PSEUDO AO format for Pt(18e)   Oleg Yazyev
• [CPMD-list] &BASIS PSEUDO AO format for Pt(18e)   Oleg Yazyev
• [CPMD-list] Mail Delivery (failure cpmd-list at cpmd.org)   zcfeng at dicp.ac.cn
• [CPMD-list] Re: Hello   t.laino at sns.it

Last message date: Wed Mar 30 20:08:05 CEST 2005
Archived on: Sat Mar 10 00:14:59 CET 2007

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