August 2005 Archives by author

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Starting: Tue Aug 2 06:45:52 CEST 2005
Ending: Tue Aug 30 12:40:45 CEST 2005
Messages: 52

• [CPMD-list] wrong velocities in TRAJECTORY?   Lan-Feng Yuan (lyuan at Princeton.EDU)
• [CPMD-list] thermostat "frequency": mu or omega?   Lan-Feng Yuan (lyuan at Princeton.EDU)
• [CPMD-list] Help:about ag cutoff!   =?gb2312?B?wu3J0NLl?=
• [CPMD-list] getting the output files just at the end   Younes Ansari
• Fw: [CPMD-list] CPMD on BlueGene   Alessandro Curioni
• [CPMD-list] Bad results during the heating phase of a md run   Reinaldo Pis Diez
• [CPMD-list] TESR with water molecules calculation   Przemyslaw Dopieralski
• [CPMD-list] CPMD/Gromos compile on IBM-SP5   Ian R. Greig
• [CPMD-list] Help, compiling problem!   Wone Keun Han
• [CPMD-list] getting the output files just at the end   Juerg Hutter
• [CPMD-list] ROKS and TDDFT of spin polarized systems   Juerg Hutter
• [CPMD-list] Band gap and hybride EXC   Juerg Hutter
• [CPMD-list] Bad results during the heating phase of a md run   Juerg Hutter
• [CPMD-list] 143 steps too long?   Juerg Hutter
• [CPMD-list] Band gap and hybride EXC   Eyvaz Isaev
• [CPMD-list] CPMD on BlueGene   Ivaylo Ivanov
• [CPMD-list] Pt TM_PBE pseudo-potential   Hong Won Keon
• [CPMD-list] Carbon and Hydrogen LMAX & LOC setting   Hong Won Keon
• [CPMD-list] Help, compiling problem!   Axel Kohlmeyer
• [CPMD-list] triclinic symmetry for disordered system   Axel Kohlmeyer
• [CPMD-list] Constant pressure MD with BO dynamics   Axel Kohlmeyer
• [CPMD-list] [help!]Problem on running test!   Axel Kohlmeyer
• [CPMD-list] Coredump on SP4   Axel Kohlmeyer
• [CPMD-list] Coredump on SP4   Axel Kohlmeyer
• [CPMD-list] CPMD/Gromos compile on IBM-SP5   Axel Kohlmeyer
• [CPMD-list] Bad results during the heating phase of a md run   Axel Kohlmeyer
• [CPMD-list] 143 steps too long?   Axel Kohlmeyer
• [CPMD-list] Compiling using IFC and MKL   Axel Kohlmeyer
• [CPMD-list] Pt TM_PBE pseudo-potential   Axel Kohlmeyer
• [CPMD-list] triclinic symmetry for disordered system   Christian Krekeler
• [CPMD-list] Re: CPMD-list Digest, Vol 16, Issue 2 (RE: Your Message)   Alex Merchant
• [CPMD-list] Ph D studentship at King's College London   Dr Carla Molteni
• [CPMD-list] ROKS and TDDFT of spin polarized systems   Eneritz Muguruza
• [CPMD-list] Constant pressure with BO dynamics   Gana Natarajan
• [CPMD-list] Constant pressure MD with BO dynamics   Gana Natarajan
• [CPMD-list] compile cpmd2cube   Jaime Sanchez
• [CPMD-list] PRFO question   Erik Santiso
• [CPMD-list] Coredump on SP4   Ari P Seitsonen
• [CPMD-list] compile cpmd2cube   Ari P Seitsonen
• [CPMD-list] Coredump on SP4   Ari P Seitsonen
• [CPMD-list] Pt TM_PBE pseudo-potential   Ari P Seitsonen
• [CPMD-list] Coredump on SP4   Balasubramanian Sundaram
• [CPMD-list] Coredump on SP4   Balasubramanian Sundaram
• [CPMD-list] Coredump on SP4   Balasubramanian Sundaram
• [CPMD-list] Coredump on SP4   Balasubramanian Sundaram
• [CPMD-list] Coredump on SP4   Balasubramanian Sundaram
• [CPMD-list] PIMD: EHAM depends on number of processors ?   Łukasz Walewski
• [CPMD-list] [help!]Problem on running test!   Yang Zhenyu
• [CPMD-list] Can not find library files!!!   Yang Zhenyu
• [CPMD-list] Compiling using IFC and MKL   yinghui lei
• [CPMD-list] 143 steps too long?   Matt wagner
• [CPMD-list] Is there any problem in this Makefile?   osirixu-cpmd at yahoo.com.cn

Last message date: Tue Aug 30 12:40:45 CEST 2005
Archived on: Sat Mar 10 00:15:01 CET 2007

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