July 2011 Archives by date

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Starting: Fri Jul 1 08:42:40 UTC 2011
Ending: Thu Jul 28 19:19:03 UTC 2011
Messages: 44

• BOMD - Total energy increasing   Sandeep Kumar Reddy
• problem in MD with constrained atoms using a Shell-model (Fist)   Gabriele Tocci
• problem in MD with constrained atoms using a Shell-model (Fist)   Gabriele Tocci
• BOMD - Total energy increasing   Axel
• Antwort: [CP2K:3347] BOMD - Total energy increasing   hut... at pci.uzh.ch
• Antwort: [CP2K:3347] BOMD - Total energy increasing   sandeep
• OpenMPI problems after compilation   wei
• Shell-model MD with constraints fails (Not yet implemented)   Gabriele Tocci
• [CP2K:3353] OpenMPI problems after compilation   Huiqun Zhou
• Help finding tutorials   stephen.jensen
• OpenMPI problems after compilation   wei
• installation of CP2k with HPMPI   Sandeep Kumar Reddy
• Regtest for evaluating build only   stephen.jensen
• failing job:err 300   jadefox337
• Help finding tutorials   jadefox337
• [CP2K:3360] failing job:err 300   Irene H.
• Job stopped after 40 steps   giulia palermo
• [CP2K:3363] Job stopped after 40 steps   Teodoro Laino
• Job stopped after 40 steps   giulia palermo
• failing job:err 300   jadefox337
• Increasing nb of cores per node degrade drastically the performance of cp2k.popt   Shadrina Maria
• Increasing nb of cores per node degrade drastically the performance of cp2k.popt   Axel
• [CP2K:3363] Job stopped after 40 steps   Jacopo Sgrignani
• Increasing nb of cores per node degrade drastically the performance of cp2k.popt   Maria Shadrina
• Increasing nb of cores per node degrade drastically the performance of cp2k.popt   Axel
• Job stopped after 40 steps   giulia palermo
• [CP2K:3372] Re: Job stopped after 40 steps   Jacopo Sgrignani
• [CP2K:3373] Re: Job stopped after 40 steps   giulia palermo
• corrupted DCD   jacopos
• Help finding tutorials   stephen.jensen
• [CP2K:3376] Re: Help finding tutorials   Teodoro Laino
• segmentation fault   Nikita
• [CP2K:3378] segmentation fault   Jörg Saßmannshausen
• segmentation fault   Nikita
• [CP2K:3380] Re: segmentation fault   Jörg Saßmannshausen
• [CP2K:3381] Re: segmentation fault   Peter Mamonov
• segmentation fault   Nikita
• [CP2K:3383] Re: segmentation fault   Peter Mamonov
• segmentation fault   Nikita
• cp2k crashes nodes?   Jörg Saßmannshausen
• cp2k crashes nodes?   Axel
• Jumps in total energy   LS
• Increasing nb of cores per node degrade drastically the performance of cp2k.popt   Maria Shadrina
• Problem with finishing of cp2k jobs   Shadrina Maria

Last message date: Thu Jul 28 19:19:03 UTC 2011
Archived on: Thu Mar 3 11:47:28 UTC 2022

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