August 2011 Archives by date

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Starting: Mon Aug 1 08:34:01 UTC 2011
Ending: Wed Aug 31 14:24:04 UTC 2011
Messages: 88

• [CP2K:3388] Re: cp2k crashes nodes?   Jörg Saßmannshausen
• BSK force field for silica   Nikita
• [CP2K:3392] BSK force field for silica   Teodoro Laino
• BSK force field for silica   Nikita
• [CP2K:3394] Re: BSK force field for silica   Teodoro Laino
• BSK force field for silica   Nikita
• stress/pressure difference   Timothy Sirk
• Cons Qty[a.u.] drift? kinetic + potential = Cons Qty ?   marco.stenta
• [CP2K:3398] Cons Qty[a.u.] drift? kinetic + potential = Cons Qty ?   Teodoro Laino
• Cons Qty[a.u.] drift? kinetic + potential = Cons Qty ?   marco.stenta
• [CP2K:3400] Re: Cons Qty[a.u.] drift? kinetic + potential = Cons Qty ?   Teodoro Laino
• Cons Qty[a.u.] drift? kinetic + potential = Cons Qty ?   marco.stenta
• [CP2K:3402] Re: Cons Qty[a.u.] drift? kinetic + potential = Cons Qty ?   Teodoro Laino
• Cons Qty[a.u.] drift? kinetic + potential = Cons Qty ?   marco.stenta
• Segmentation Fault using ROKS   Frank Uhlig
• ERROR in topology_generate_molecule   Nikita
• [CP2K:3406] ERROR in topology_generate_molecule   Teodoro Laino
• ERROR in topology_generate_molecule   Nikita
• [CP2K:3408] Re: ERROR in topology_generate_molecule   Teodoro Laino
• ERROR in topology_generate_molecule   Nikita
• [CP2K:3410] Re: ERROR in topology_generate_molecule   Teodoro Laino
• ERROR in topology_generate_molecule   Nikita
• TZVP/TZV2P basis set for Zn   marco.stenta
• units of lagrange multiplier   Ali
• Thermostat regions in MD   Philippe C. A.
• [CP2K:3415] Thermostat regions in MD   Teodoro Laino
• Installation problem: Can't open module file   Janos... at googlemail.com
• [CP2K:3417] Installation problem: Can't open module file   Alin Marin Elena
• Installation problem: Can't open module file   Janos... at googlemail.com
• [CP2K:3419] Re: Installation problem: Can't open module file   Carlos Campana
• Thermostat regions in MD   Philippe C. A.
• [CP2K:3421] Re: Thermostat regions in MD   Teodoro Laino
• [CP2K:3419] Re: Installation problem: Can't open module file   Alin Marin Elena
• Cell_opt Ever-expanding Cell   Matthew Harrigan
• Cell_opt Ever-expanding Cell   Michal Kochman
• [FYI] Segfault with hybrid functionals   nadler
• ScaLAPACK bugs and possible alternatives   Nichols A. Romero
• [CP2K:3427] ScaLAPACK bugs and possible alternatives   Ondrej Marsalek
• ERROR in check_subsys_element (MODULE topology_util)   jadefox337
• ERROR in check_subsys_element (MODULE topology_util)   jadefox337
• [CP2K:3429] ERROR in check_subsys_element (MODULE topology_util)   Teodoro Laino
• ERROR in check_subsys_element (MODULE topology_util)   jadefox337
• [CP2K:3432] Re: ERROR in check_subsys_element (MODULE topology_util)   Teodoro Laino
• ERROR in check_subsys_element (MODULE topology_util)   jadefox337
• [CP2K:3425] Re: Cell_opt Ever-expanding Cell   Matthew Harrigan
• Phonon calculation   Matthew Harrigan
• [CP2K:3425] Re: Cell_opt Ever-expanding Cell   Axel
• Molecular Orbital Cube Files for Charged System   Irene H.
• Molecular Orbital Cube Files for Charged System   flo
• [CP2K:3439] Re: Molecular Orbital Cube Files for Charged System   Irene H.
• GCMC   Isaak Daniels
• GCMC   Matt McGrath
• GCMC   Isaak Daniels
• GCMC   Matt McGrath
• MD doesn't run   Nikita
• [CP2K:3445] MD doesn't run   Teodoro Laino
• [CP2K:3446] MD doesn't run   Nikita Vakula
• [CP2K:3447] MD doesn't run   Teodoro Laino
• GCMC   Isaak Daniels
• [CP2K:3448] MD doesn't run   Nikita Vakula
• SCP_NDDO   LS
• GCMC   Matt McGrath
• [CP2K:3451] SCP_NDDO   hut... at pci.uzh.ch
• GCMC   Isaak Daniels
• SCP_NDDO   LS
• GCMC   Matt McGrath
• GCMC   Isaak Daniels
• Problem with installation   Isaak Daniels
• GCMC   Isaak Daniels
• GCMC   Isaak Daniels
• GCMC   Isaak Daniels
• GCMC   Matt McGrath
• GCMC   Isaak Daniels
• GCMC   Isaak Daniels
• GCMC   Matt McGrath
• [CP2K:3459] Problem with installation   Urban Borštnik
• GCMC   Isaak Daniels
• Problem with installation   Isaak Daniels
• [CP2K:3469] Re: Problem with installation   Urban Borštnik
• GCMC   Matt McGrath
• Problem with installation   Isaak Daniels
• [CP2K:3472] Re: Problem with installation   Urban Borštnik
• GCMC   Isaak Daniels
• Basis set confusion   Matthew
• GCMC   Matt McGrath
• energy convergence question   Alin Marin Elena
• Problem with installation   Isaak Daniels
• [CP2K:3478] Re: Problem with installation   Daniele Varsano

Last message date: Wed Aug 31 14:24:04 UTC 2011
Archived on: Thu Mar 3 11:47:29 UTC 2022

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