August 2004 Archives by date
Starting: Sun Aug 1 05:23:52 CEST 2004
Ending: Tue Aug 31 15:30:59 CEST 2004
Messages: 238
- [Wien] Meta-GGA
L. D. Marks
- [Wien] Need help about compiling
Daniel Zhu
- [Wien] Band Gap problem
Javad Hashemifar
- Odp: [Wien] Need help about compiling
K. Ruebenbauer
- Odp: [Wien] Band Gap problem
K. Ruebenbauer
- Odp: [Wien] Meta-GGA
K. Ruebenbauer
- Odp: [Wien] Band Gap problem
K. Ruebenbauer
- Odp: [Wien] Thanks
K. Ruebenbauer
- Odp: [Wien] supercell struct
K. Ruebenbauer
- [Wien] Meta-GGA
Stefaan Cottenier
- [Wien] Band Gap problem
Naeini Ashkan
- [Wien] Band Gap problem
Naeini Ashkan
- [Wien] LDA+U
Yushan Wang
- [Wien] cfg
Lena Fitting
- [Wien] LDA+U
Stefaan Cottenier
- [Wien] for the cherge density ploting
george bush
- [Wien] WARN: Not all eigenvectors are orthogonal, and CLUSTERSIZE parameter
Valerio Bellini
- [WIEN] unexpected error in LAPW2
nluo at uiuc.edu
- [Wien] (no subject)
Yushan Wang
- [Wien] (no subject)
Yushan Wang
- [Wien] PORT, atomic position relaxation
krutibas panda
- [Wien] PORT, atomic position relaxation
L. D. Marks
- [WIEN] unexpected error in LAPW2
Stefaan Cottenier
- [Wien] (no subject)
Stefaan Cottenier
- [Wien] OT: Si(111)-sqrt(3)xsqrt(3)
Michael Gurnett
- [Wien] different dopants in CdTe
george bush
- [Wien] PORT, atomic position relaxation
krutibas panda
- [Wien] PORT, atomic position relaxation
Stefaan Cottenier
- [Wien] different dopants in CdTe
Stefaan Cottenier
- [Wien] PORT, atomic position relaxation
Stefaan Cottenier
- [Wien] Monoclinic problem
Daniel Zhu
- [WIEN] unexpected error in LAPW2
nluo at uiuc.edu
- [Wien] turn off bloechl correction?
Michelle Johannes
- [Wien] (no subject)
Artem Urubkov
- [Wien] MINI
fabella
- [Wien] MINI
Stefaan Cottenier
- [Wien] error in k-point parallel execution
Mahmoud Payami
- [Wien] error in k-point parallel execution
Torsten Andersen
- [Wien] error in locking authority file /home/mahmoud/.Xauthority
Mahmoud Payami
- [Wien] error in locking authority file /home/mahmoud/.Xauthority
Torsten Andersen
- [Wien] error in locking authority file /home/mahmoud/.Xauthority
Mahmoud Payami
- [Wien] about the variables in lcore
Zhou Taojun
- [Wien] How to input the structure file for the Mo2N structure
yanming Ma
- [Wien] format of structure file
Jutta Rogal
- [Wien] about the variables in lcore
georg at chem.au.dk
- [Wien] 4f in core
jan kunes
- [Wien] How to input the structure file for the Mo2N structure
Yushan Wang
- [Wien] 4f in core
Javad Hashemifar
- [Wien] how to add the additional electron
Zhou Taojun
- [Wien] Some (bug ?) in SRC_lapwdm/l2main.frc in determining NEMIN, NEMAX
Tianjiao Zhang
- [Wien] fermilevel not converged
Yushan Wang
- [Wien] How to Write the struct file??
liuzw03 at st.lzu.edu.cn
- [Wien] How to input the structure file for the Mo2N structure
yanming Ma
- [Wien] Port option of mini
Michael Gurnett
- [Wien] How to Write the struct file??
Torsten Andersen
- [Wien] Problem compiling cif2struct on hp machines
Rebecca Nicholls
- [Wien] Problem compiling cif2struct on hp machines
L. D. Marks
- [Wien] Port option of mini
L. D. Marks
- [Wien] How to input the structure file for the Mo2N structure
L. D. Marks
- [Wien] How to Write the struct file??
liuzw03 at st.lzu.edu.cn
- [Wien] How to Write the struct file??
Fred Nastos
- [Wien] Nd2Fe14B
Sherif Yehia
- [Wien] Port option of mini
Michael Gurnett
- [Wien] Nd2Fe14B
Yushan Wang
- [Wien] Nd2Fe14B
Stefaan Cottenier
- [Wien] How to Write the struct file??
liuzw03 at st.lzu.edu.cn
- [Wien] how to add the additional electron
Zhou Taojun
- [Wien] Nd2Fe14B
Sherif Yehia
- [Wien] how to add the additional electron
Stefaan Cottenier
- [Wien] Nd2Fe14B
Jorissen Kevin
- [Wien] Nd2Fe14B
Stefaan Cottenier
- [Wien] DOS : missing electrons
Abir De Sarkar
- [Wien] DOS : missing electrons
Stefaan Cottenier
- [Wien] DOS : missing electrons
Abir De Sarkar
- [Wien] DOS : missing electrons
Stefaan Cottenier
- [Wien] DOS : missing electrons
Abir De Sarkar
- [Wien] DOS : missing electrons
Stefaan Cottenier
- [Wien] Fixed Spin Moment Calu.
Ashok Kumar Verma
- [Wien] Fixed Spin Moment Calu.
Jorissen Kevin
- [Wien] Supercell
Rezaei Behrooz
- [Wien] the puzzle elastic constant
zhgh at theory.issp.ac.cn
- [Wien] Supercell
Stefaan Cottenier
- [Wien] Port option of mini
L. D. Marks
- [Wien] P and H differences
Peter Blaha
- [Wien] q re: 'local coordinates' and px, py, pz
Peter Blaha
- [Wien] Meta-GGA
Peter Blaha
- [Wien] WARN: Not all eigenvectors are orthogonal, and CLUSTERSIZE
parameter
Peter Blaha
- [Wien] format of structure file
Peter Blaha
- [Wien] 4f in core
Peter Blaha
- [Wien] Some (bug ?) in SRC_lapwdm/l2main.frc in determining
NEMIN, NEMAX
Peter Blaha
- [Wien] lapw5.def
fabella
- [Wien] lapw5.def
georg at chem.au.dk
- [Wien] lapw5.def
Marco Schowalter
- [Wien] error while loading shared libraries
Mahmoud Payami
- [Wien] error while loading shared libraries
Stefaan Cottenier
- [Wien] error while loading shared libraries
Mahmoud Payami
- [Wien] error while loading shared libraries
Torsten Andersen
- [Wien] error while loading shared libraries
Mahmoud Payami
- [Wien] q re: 'local coordinates' and px, py, pz
Cormac McGuinness
- [Wien] missing electrons
Abir De Sarkar
- [Wien] error while loading shared libraries
Mahmoud Payami
- [Wien] error while loading shared libraries
Jorissen Kevin
- [Wien] Problem in SP+SO calculation
Shunli Shang
- [Wien] error while loading shared libraries
L. D. Marks
- [Wien] missing electrons
Peter Blaha
- [Wien] q re: 'local coordinates' and px, py, pz
Peter Blaha
- [Wien] sign change in Mini
Jack London
- [Wien] sign change in Mini
L. D. Marks
- [Wien] sign change in Mini
L. D. Marks
- [Wien] sign change in Mini
Jack London
- [Wien] sign change in Mini
L. D. Marks
- [Wien] Cannot access userguide from w2web
L. D. Marks
- [Wien] Problem compiling cif2struct on hp machines
Peter Blaha
- [Wien] excitation between the valence and the conduction band
Yushan Wang
- [Wien] help on saved files
Daniel Zhu
- [Wien] Cannot access userguide from w2web
Peter Blaha
- [Wien] Problem in SP+SO calculation
Torsten Andersen
- [Wien] help on saved files
Stefaan Cottenier
- [Wien] Problem in SP+SO calculation
Peter Blaha
- [Wien] turn off bloechl correction?
Peter Blaha
- [Wien] error while loading shared libraries
Mahmoud Payami
- [Wien] missing electrons
Rossitza Pentcheva
- [Wien] missing electrons
Peter Blaha
- [Wien] Problem in SP+SO calculation
Shunli Shang
- [Wien] turn off bloechl correction?
jan kunes
- [Wien] XSPEC valence lifetime Bbroadening
Andrei Postnikov
- [Wien] min force
WANG Yuan Xu
- [Wien] min force
L. D. Marks
- [Wien] min force
WANG Yuan Xu
- [Wien] min force
L. D. Marks
- [Wien] min force
Jack London
- [Wien] forrtl: severe (174): SIGSEGV, segmentation fault occurred
Mahmoud Payami
- [Wien] min force
L. D. Marks
- [Wien] forrtl: severe (174): SIGSEGV, segmentation fault occurred
Fred Nastos
- [Wien] forrtl: severe (174): SIGSEGV, segmentation fault occurred
Mahmoud Payami
- [Wien] forrtl: severe (174): SIGSEGV, segmentation fault occurred
Fred Nastos
- [Wien] forrtl: severe (174): SIGSEGV, segmentation fault occurred
L. D. Marks
- [Wien] min force
WANG YX
- [Wien] min force
L. D. Marks
- [Wien] forrtl: severe (174): SIGSEGV, segmentation fault occurred
Mahmoud Payami
- [Wien] XSPEC valence lifetime Bbroadening
buero at luitz.at
- [Wien] sgroup: Bb and P-1
georg at chem.au.dk
- [Wien] sgroup: Bb and P-1
georg at chem.au.dk
- [Wien] forrtl: severe (174): SIGSEGV, segmentation fault occurred
L. D. Marks
- [Wien] Installation help required
apu at veccal.ernet.in
- [Wien] Dimension Parameter
Peter Blaha
- [Wien] Dimension Parameter
Peter Blaha
- [Wien] (no subject)
Mathrubutham Rajagopalan
- [Wien] LDA+U
Yushan Wang
- [Wien] LDA+U for La2O3
SIC CAS
- [Wien] Dimension Parameter
mohammadi at nano.ipm.ac.ir
- [Wien] min force
WANG YX
- [Wien] coordinate of rotation matrix
Zhou Taojun
- [Wien] min force
L. D. Marks
- [Wien] [Wien2k-announce] New Version of WIEN2k
Peter Blaha
- [Wien] (no subject)
Stefaan Cottenier
- [Wien] (no subject)
Peter Blaha
- [Wien] LDA+U
Yushan Wang
- [Wien] LDA+U
thomas.mazet
- [Wien] post on list
Su Hao
- [Wien] LDA+U for La2O3
Peter Blaha
- [Wien] submitting jobs interactivly
Travis Sefzik
- [Wien] LDA+U
Stefaan Cottenier
- [Wien] submitting jobs interactivly
Matthew D. Jones
- [Wien] LDA+U for La2O3
SIC CAS
- [Wien] clmsum
Travis Sefzik
- [Wien] clmsum
Jorissen Kevin
- [Wien] LDA+U for La2O3
Peter Blaha
- [Wien] LDA+U for La2O3
SIC CAS
- [Wien] clmsum
Torsten Andersen
- [Wien] forrtl: severe (174): SIGSEGV, segmentation fault occurred
Mahmoud Payami
- [Wien] Re: min force
WANG YX
- [Wien] forrtl: severe (174): SIGSEGV, segmentation fault occurred
Steven Steven Homolya
- [Wien] Mini NEWT
Torsten Andersen
- [Wien] siteconfig does not update C compiler selection
Steven Homolya
- [Wien] missing electrons
Abir De Sarkar
- [Wien] forrtl: severe (174): SIGSEGV, segmentation fault occurred
Mahmoud Payami
- [Wien] core leakage
Saeid Jalali
- [Wien] core leakage
Travis Sefzik
- [Wien] forrtl: severe (174): SIGSEGV, segmentation fault occurred
Jorissen Kevin
- [Wien] core leakage
Jorissen Kevin
- [Wien] Re: min force
L. D. Marks
- [Wien] wien97
Travis Sefzik
- [Wien] wien97
Jorissen Kevin
- [Wien] forrtl: severe (174): SIGSEGV,
segmentation fault occurred
Steven Steven Homolya
- [Wien] wien97
Torsten Andersen
- [Wien] The explanation of file case.outputt
Dong YuHui
- [Wien] problem with total energy
Dong YuHui
- [Wien] hexagonal str
Saeid Jalali
- [Wien] The explanation of file case.outputt
Peter Blaha
- [Wien] problem with total energy
Peter Blaha
- [Wien] hexagonal str
Kulkova S.E.
- [Wien] hexagonal str
georg at chem.au.dk
- [Wien] siteconfig does not update C compiler selection
Peter Blaha
- [Wien] [Wien2k-announce] New Version of WIEN2k
Torsten Andersen
- [Wien] Re: min force
WANG YX
- [Wien] TiNi3 struct
Chudinov D.V.
- [Wien] [Wien2k-announce] New Version of WIEN2k
Torsten Andersen
- [Wien] [Wien2k-announce] New Version of WIEN2k
Peter Blaha
- [Wien] TiNi3 struct
Peter Blaha
- [Wien] OMP abort: stack overflow detected
Mahmoud Payami
- [Wien] TiNi3 struct
Chudinov D.V.
- [Wien] TiNi3 struct
Peter Blaha
- [Wien] what mesh (real space) is used in WIEN2k? (Artem Urubkov)
auru
- [Wien] what mesh (real space) is used in WIEN2k? (Artem Urubkov)
Fred Nastos
- [Wien] TiNi3 struct
Chudinov D.V.
- [Wien] -Isolated molecules of benzene - my approach has not led me further than "dstart"
Komolov
- [Wien] -Isolated molecules of benzene - my approach has not led me further than "dstart"
Jorissen Kevin
- [Wien] -Isolated molecules of benzene - my approach has not led me further than "dstart"
Andrei Postnikov
- [Wien] need a reply from Pro.Blaha about the w2web installing
Yushan Wang
- [Wien] need a reply from Pro.Blaha about the w2web installing
Torsten Andersen
- [Wien] Re: min force
L. D. Marks
- [Wien] Re: min force
Michael Gurnett
- [Wien] nn command not found
Saeid Jalali
- [Wien] nn command not found
apu at veccal.ernet.in
- [Wien] (no subject)
Yushan Wang
- [Wien] (no subject)
Stefaan Cottenier
- [Wien] Re: min force
L. D. Marks
- [Wien] need a reply from Pro.Blaha about the w2web installing
Peter Blaha
- [Wien] forces in mini
KARLA
- [Wien] H core state
Cesar Lazo
- [Wien] some elnes scripts
Michael Frotscher
- [Wien] forces in mini
L. D. Marks
- [Wien] some elnes scripts
Jorissen Kevin
- [Wien] to all TELNES users
Jorissen Kevin
- [Wien] to all TELNES users
L. D. Marks
- [Wien] H core state
Peter Blaha
- [Wien] to all TELNES users
Pavel Novak
- [Wien] to all TELNES users
Jorissen Kevin
- [Wien] surface generation
arnaud.vasseur at caramail.com
- [Wien] to all TELNES users
Philippe Moreau
- [Wien] about the time
Yushan Wang
- [Wien] to all TELNES users
L. D. Marks
- [Wien] little fortran question
koitzsch
- [Wien] News from Vienna - personal info
buero at luitz.at
- [Wien] little fortran question
Dr. Sharat Chandra
- [Wien] little fortran question
Andrew Smith
- [Wien] OMP abort: stack overflow detected
Mahmoud Payami
Last message date:
Tue Aug 31 15:30:59 CEST 2004
Archived on: Wed Jul 6 14:14:18 CEST 2005
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