November 2010 Archives by subject

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Starting: Mon Nov 1 18:13:49 UTC 2010
Ending: Mon Nov 29 18:00:04 UTC 2010
Messages: 58

• [CP2K:2890] Re: Problems of IR and dipole calculation   Fawzi Mohamed
• [CP2K:2896] How to use git as a client for the CVS server   Toon Verstraelen
• [CP2K:2897] IR spectr of X-D2O: discrepancy from band analysis of stretches   Fawzi Mohamed
• [CP2K:2900] How to use git as a client for the CVS server   hut... at pci.uzh.ch
• [CP2K:2901] About cp2k problem   Toon Verstraelen
• [CP2K:2903] About cp2k problem   Toon Verstraelen
• [CP2K:2904] How to use git as a client for the CVS server   Toon Verstraelen
• [CP2K:2908] mode selective MS_RESTART patch   Buddhadev Maiti
• [CP2K:2909] section SCREENING is required   Fawzi Mohamed
• [CP2K:2915] Lowest Eigenvalues of the unoccupied subspace spin did not converge in ot_eigensolver -- UV intensities   hut... at pci.uzh.ch
• [CP2K:2916] resp charges and excited states   hut... at pci.uzh.ch
• [CP2K:2918] resp charges and excited states   Pablo M. De Biase
• [CP2K:2919] resp charges and excited states   hut... at pci.uzh.ch
• [CP2K:2921] libdbcsr, MPI error   Urban Borštnik
• [CP2K:2927] SCRF with piriodic condition   Teodoro Laino
• [CP2K:2928] DFT-D   hut... at pci.uzh.ch
• [CP2K:2930] Re: DFT-D   hut... at pci.uzh.ch
• [CP2K:2931] Re: DFT-D   Jörg Saßmannshausen
• [CP2K:2932] Illegal use of symbol gamma (cluster_methods.f90   Teodoro Laino
• [CP2K:2935] Re: how to compute polarization   Hanning Chen
• [CP2K:2936] Puzzled by QM/MM Error   Teodoro Laino
• [CP2K:2941] Re: bug in cp_fm_invert ?   Hanning Chen
• [CP2K:2943] Re: bug in cp_fm_invert ?   Hanning Chen
• [CP2K:2945] Re: bug in cp_fm_invert ?   Hanning Chen
• [CP2K:2946] Re: libdbcsr, MPI error   Teodoro Laino
• [CP2K:2946] Re: libdbcsr, MPI error   Pietro Vidossich
• [CP2K:2949] Re: libdbcsr, MPI error   Pietro Vidossich
• [CP2K:2953] Force fields for water   Teodoro Laino
• About cp2k problem   Buddhadev Maiti
• About cp2k problem   Buddhadev Maiti
• Absolute validation   Toon Verstraelen
• bug in cp_fm_invert ?   Hanning Chen
• bug in cp_fm_invert ?   flo
• bug in cp_fm_invert ?   flo
• bug in cp_fm_invert ?   flo
• bug in cp_fm_invert ?   flo
• constraints and TS search   Dan_M
• DFT-D   Jörg Saßmannshausen
• DFT-D   Matt W
• Force fields for water   LS
• how to compute polarization   jadefox337
• how to compute polarization   nadler
• how to compute polarization   jadefox337
• Illegal use of symbol gamma (cluster_methods.f90   maria
• IR spectr of X-D2O: discrepancy from band analysis of stretches   jadefox337
• libdbcsr, MPI error   nadler
• libdbcsr, MPI error   nadler
• libdbcsr, MPI error   nadler
• libdbcsr, MPI error   nadler
• Lowest Eigenvalues of the unoccupied subspace spin did not converge in ot_eigensolver -- UV intensities   Pablo M. De Biase
• mode selective MS_RESTART patch   Toon Verstraelen
• Montecarlo   Francesco
• Montecarlo   Matt McGrath
• Puzzled by QM/MM Error   Ali
• resp charges and excited states   Pablo M. De Biase
• SCRF Calculation   xujroman
• SCRF with piriodic condition   Nguyen Ngoc Ha
• section SCREENING is required   Pablo M. De Biase

Last message date: Mon Nov 29 18:00:04 UTC 2010
Archived on: Thu Mar 3 11:47:27 UTC 2022

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