2008 Archives by thread
Starting: Mon Feb 4 14:25:33 CET 2008
Ending: Tue Dec 30 20:08:20 CET 2008
Messages: 94
- [DFTB-Plus-User] restarting jobs
Duncan Riley
- [DFTB-Plus-User] (no subject)
Mathieu Dubois
- [DFTB-Plus-User] CNT(12,7) Density of States trouble
david at ufma.br
- [DFTB-Plus-User] [Fwd: Re: (no subject)]]
Balint Aradi
- [DFTB-Plus-User] Parameters for Boron?
ulfek at few.vu.nl
- [DFTB-Plus-User] Memory usage and CPU time
Zbigniew Romanowski
- [DFTB-Plus-User] Question about angular momentum conservation in molecular dynamics runs into DFTB
Reinaldo Pis Diez
- [DFTB-Plus-User] Compiling Error
Marcelo Zimmer
- [DFTB-Plus-User] Cell Parameters Optimization
Marcelo Zimmer
- [DFTB-Plus-User] what is the largest system treated with DFTB so far
ekadants at babylon.phy.nrc.ca
- [DFTB-Plus-User] dosplot error
YAO DONGLAI
- [DFTB-Plus-User] DFTB-Plus-User Digest, Vol 8, Issue 1
YAO DONGLAI
- [DFTB-Plus-User] DFTB-Plus-User Digest, Vol 8, Issue 2
YAO DONGLAI
- [DFTB-Plus-User] Numeric Module problem solved
YAO DONGLAI
- [DFTB-Plus-User] molecule impacts in dftb+
Axel Maeyens
- [DFTB-Plus-User] F-S skf file
Zhu, Lingyun
- [DFTB-Plus-User] About the cost of this software if used to be published
hezi_826
- [DFTB-Plus-User] About the fee for using DFTB software to publish articles
hezi_826
- [DFTB-Plus-User] DFTB compiling Error
gurinder singh
- [DFTB-Plus-User] Max Number of Atoms
Marcelo Zimmer
- [DFTB-Plus-User] DFTB Plus compiling Error
gurinder singh
- [DFTB-Plus-User] Ge-Si,Ge-Ge
YAO DONGLAI
- [DFTB-Plus-User] lattice constants in a periodic structure/ new version of code
Axel Maeyens
- [DFTB-Plus-User] Complied dftb-plus successfully, but can not invoke it
#WU XING#
- [DFTB-Plus-User] What's the "executable x86_64-linux-ifort" file for?
Bálint Aradi
- [DFTB-Plus-User] DFTB QM/MM Implementation
Christopher Rowan
- [DFTB-Plus-User] SK Files for Au
Christopher Rowan
- [DFTB-Plus-User] Compilation error
Seung Mi Lee
- [DFTB-Plus-User] compilation error in another machine
Seung Mi Lee
- [DFTB-Plus-User] restart
Bálint Aradi
- [DFTB-Plus-User] Failure on MD run
HAYDEE VALDES GONZALEZ
- [DFTB-Plus-User] Failure on OPT run
HAYDEE VALDES GONZALEZ
- [DFTB-Plus-User] Error message of "severe (174): SIGSEGV, segmentation fault occurred"
#WU XING#
- [DFTB-Plus-User] DFTB-Plus-User Digest, Vol 12, Issue 1
HAYDEE VALDES GONZALEZ
- [DFTB-Plus-User] Error message of "severe (174): SIGSEGV, segmentation
#WU XING#
- [DFTB-Plus-User] RE Ben: Error message of "severe (174): SIGSEGV, segmentation fault occurred"
#WU XING#
- [DFTB-Plus-User] Recall: RE Ben: Error message of "severe (174): SIGSEGV, segmentation fault occurred"
#WU XING#
- [DFTB-Plus-User] {H, C, N, O, S, Mg} Slater-Koster file
北川 裕也
- [DFTB-Plus-User] DFTB+ information
Bálint Aradi
- [DFTB-Plus-User] Failure of routine zhegvd
hfox1 at nd.edu
- [DFTB-Plus-User] Thank you.
Seung Mi Lee
- [DFTB-Plus-User] About dispersion
北川 裕也
- [DFTB-Plus-User] snapshot compilation error(gfortran)
Seung Mi Lee
- [DFTB-Plus-User] no error message, but stopped.
Seung Mi Lee
Last message date:
Tue Dec 30 20:08:20 CET 2008
Archived on: Fri Jul 19 10:37:02 CEST 2024
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